*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   14-SEP-06   2IDA              
*TITLE     SOLUTION STRUCTURE OF CONSERVED HYPOTHETICAL PROTEIN                  
*TITLE    2 RPA1320 FROM RHODOPSEUDOMONAS PALUSTRIS; NORTHEAST                   
*TITLE    3 STRUCTURAL GENOMICS CONSORTIUM TARGET RPT3 / ONTARIO                 
*TITLE    4 CENTER FOR STRUCTURAL PROTEOMICS TARGET RP1313                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: HYPOTHETICAL PROTEIN;                                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: RHODOPSEUDOMONAS PALUSTRIS;                     
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 GENE: RPA1320;                                                       
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21 DE3(GOLD);                            
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: P11                                   
*KEYWDS    ZINC BINDING PROTEIN, STRUCTURAL GENOMICS, PSI-2, PROTEIN             
*KEYWDS   2 STRUCTURE INITIATIVE, NORTHEAST STRUCTURAL GENOMICS                  
*KEYWDS   3 CONSORTIUM, NESG                                                     
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    A.LEMAK, A.YEE, J.A.LUKIN, M.KARRA, A.GUTMANAS, V.GUIDO,              
*AUTHOR   2 C.H.ARROWSMITH, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM             
*AUTHOR   3 (NESG)                                                               
*REVDAT   1   24-OCT-06 2IDA    0                                                


constraints/0040700002045500006010000000000010502333175012740 5ustar  alemakoarrowconstraints/rp1313_noe.tbl0100600002045500006010000054446410502333152015250 0ustar  alemakoarrowassign ( resid   82 and name HA   )   ( resid   83 and name HN   )   4.00  2.20  1.00
assign ( resid   82 and name HA   )   ( resid   82 and name HG2  )   4.00  2.20  1.00
assign ( resid   82 and name HA   )   ( resid   82 and name HG1  )   4.00  2.20  1.00
assign ( resid   82 and name HB1  )   ( resid   83 and name HN   )   4.00  2.20  1.00
assign ( resid   82 and name HG2  )   ( resid   83 and name HN   )   4.00  2.20  2.00
assign ( resid   25 and name HA   )   ( resid   25 and name HG   )   4.00  2.20  1.00
assign ( resid   25 and name HA   )   ( resid   25 and name HD1* )   4.00  2.20  1.00
assign ( resid   25 and name HB1  )   ( resid   25 and name HD1* )   3.00  1.20  0.50
assign ( resid   25 and name HB2  )   ( resid   25 and name HD1* )   3.00  1.20  0.50
assign ( resid   25 and name HA   )   ( resid   25 and name HD2* )   4.00  2.20  1.00
assign ( resid   25 and name HB1  )   ( resid   25 and name HD2* )   3.00  1.20  0.50
assign ( resid   25 and name HB2  )   ( resid   25 and name HD2* )   3.00  1.20  0.50
assign ( resid   19 and name HA   )   ( resid   19 and name HG   )   4.00  2.20  1.00
assign ( resid   19 and name HA   )   ( resid   19 and name HD1* )   4.00  2.20  1.00
assign ( resid   19 and name HB1  )   ( resid   98 and name HG12 )   4.00  2.20  1.00
assign ( resid   19 and name HB1  )   ( resid   19 and name HD1* )   4.00  2.20  1.00
assign ( resid   19 and name HB2  )   ( resid   19 and name HD1* )   3.00  1.20  0.50
assign ( resid   19 and name HA   )   ( resid   19 and name HD2* )   4.00  2.20  1.00
assign ( resid   19 and name HB1  )   ( resid   19 and name HD2* )   4.00  2.20  1.00
assign ( resid   19 and name HB2  )   ( resid   19 and name HD2* )   3.00  1.20  0.50
assign ( resid   26 and name HA   )   ( resid   26 and name HG2  )   4.00  2.20  1.00
assign ( resid   26 and name HB*  )   ( resid   26 and name HD*  )   3.00  1.20  0.50
assign ( resid   26 and name HA   )   ( resid   26 and name HG1  )   4.00  2.20  1.00
assign ( resid   24 and name HA   )   ( resid   26 and name HG2  )   4.00  2.20  1.00
assign ( resid   26 and name HG2  )   ( resid   26 and name HE*  )   4.00  2.20  1.00
assign ( resid   24 and name HA   )   ( resid   26 and name HD*  )   4.00  2.20  1.00
assign ( resid   26 and name HA   )   ( resid   26 and name HD*  )   4.00  2.20  2.00
assign ( resid   26 and name HG1  )   ( resid   26 and name HD*  )   3.00  1.20  0.50
assign ( resid   26 and name HA   )   ( resid   26 and name HE*  )   4.00  2.20  2.00
assign ( resid   26 and name HB*  )   ( resid   26 and name HE*  )   4.00  2.20  1.00
assign ( resid   26 and name HG1  )   ( resid   26 and name HE*  )   4.00  2.20  1.00
assign ( resid   35 and name HD2  )   ( resid   46 and name HA   )   4.00  2.20  2.00
assign ( resid    8 and name HA   )   ( resid    8 and name HG1* )   3.00  1.20  0.50
assign ( resid   12 and name HD*  )   ( resid   14 and name HG1* )   4.00  2.20  1.00
assign ( resid    8 and name HA   )   ( resid    8 and name HG2* )   3.00  1.20  0.50
assign ( resid   26 and name HG1  )   ( resid   27 and name HA   )   4.00  2.20  2.00
assign ( resid   27 and name HG2* )   ( resid   27 and name HG12 )   4.00  2.20  1.00
assign ( resid   27 and name HA   )   ( resid   27 and name HG2* )   3.00  1.20  0.50
assign ( resid   27 and name HG2* )   ( resid   27 and name HG11 )   4.00  2.20  1.00
assign ( resid   26 and name HG1  )   ( resid   27 and name HG2* )   4.00  2.20  1.00
assign ( resid   27 and name HA   )   ( resid   27 and name HD1* )   4.00  2.20  1.00
assign ( resid   27 and name HB   )   ( resid   27 and name HD1* )   3.00  1.20  0.50
assign ( resid   27 and name HG2* )   ( resid   27 and name HD1* )   3.00  1.20  0.50
assign ( resid   90 and name HA   )   ( resid   90 and name HG2  )   3.00  1.20  0.50
assign ( resid   90 and name HA   )   ( resid   90 and name HG1  )   4.00  2.20  1.00
assign ( resid   90 and name HB1  )   ( resid   90 and name HG2  )   3.00  1.20  0.50
assign ( resid   90 and name HA   )   ( resid   90 and name HD*  )   4.00  2.20  1.00
assign ( resid   90 and name HB2  )   ( resid   90 and name HD*  )   3.00  1.20  0.50
assign ( resid   90 and name HB1  )   ( resid   90 and name HD*  )   3.00  1.20  0.50
assign ( resid   73 and name HA   )   ( resid   73 and name HG1  )   4.00  2.20  1.00
assign ( resid   73 and name HA   )   ( resid   73 and name HG2  )   4.00  2.20  1.00
assign ( resid   56 and name HA   )   ( resid   56 and name HG2  )   4.00  2.20  1.00
assign ( resid   56 and name HA   )   ( resid   56 and name HD*  )   4.00  2.20  1.00
assign ( resid   56 and name HA   )   ( resid   56 and name HG1  )   4.00  2.20  1.00
assign ( resid   56 and name HB2  )   ( resid   56 and name HD*  )   3.00  1.20  0.50
assign ( resid   56 and name HG2  )   ( resid   56 and name HD*  )   3.00  1.20  0.50
assign ( resid   56 and name HB1  )   ( resid   56 and name HD*  )   3.00  1.20  0.50
assign ( resid   55 and name HA   )   ( resid   55 and name HG2* )   3.00  1.20  0.50
assign ( resid    1 and name HA   )   ( resid    1 and name HB*  )   3.00  1.20  0.50
assign ( resid    3 and name HA   )   ( resid    3 and name HG2  )   4.00  2.20  1.00
assign ( resid   61 and name HA   )   ( resid   61 and name HB   )   3.00  1.20  0.50
assign ( resid   61 and name HA   )   ( resid   61 and name HG2* )   3.00  1.20  0.50
assign ( resid   11 and name HA   )   ( resid   11 and name HG11 )   4.00  2.20  1.00
assign ( resid   17 and name HN   )   ( resid   36 and name HG11 )   4.00  2.20  2.00
assign ( resid   11 and name HG2* )   ( resid   11 and name HG11 )   4.00  2.20  1.00
assign ( resid   11 and name HA   )   ( resid   11 and name HG2* )   3.00  1.20  0.50
assign ( resid   11 and name HG2* )   ( resid   11 and name HG12 )   3.00  1.20  0.50
assign ( resid   11 and name HG2* )   ( resid   65 and name HB   )   3.00  1.20  0.50
assign ( resid   11 and name HG2* )   ( resid   11 and name HD1* )   2.00  0.20  0.70
assign ( resid   11 and name HA   )   ( resid   11 and name HD1* )   4.00  2.20  1.00
assign ( resid   11 and name HB   )   ( resid   11 and name HD1* )   3.00  1.20  0.50
assign ( resid   11 and name HD1* )   ( resid   65 and name HG2* )   3.00  1.20  0.50
assign ( resid    2 and name HA   )   ( resid    2 and name HG2* )   3.00  1.20  0.50
assign ( resid   83 and name HA   )   ( resid   83 and name HG2* )   4.00  2.20  1.00
assign ( resid   83 and name HA   )   ( resid   83 and name HG1* )   3.00  1.20  0.50
assign ( resid   14 and name HA   )   ( resid   14 and name HG1* )   3.00  1.20  0.50
assign ( resid   14 and name HA   )   ( resid   14 and name HG2* )   3.00  1.20  0.50
assign ( resid   14 and name HG1* )   ( resid   38 and name HA   )   3.00  1.20  0.50
assign ( resid   14 and name HG2* )   ( resid   38 and name HA   )   3.00  1.20  0.50
assign ( resid   36 and name HG2* )   ( resid   36 and name HG12 )   3.00  1.20  0.50
assign ( resid    3 and name HA   )   ( resid    3 and name HG1  )   4.00  2.20  1.00
assign ( resid   84 and name HA   )   ( resid   84 and name HG*  )   4.00  2.20  1.00
assign ( resid   43 and name HA   )   ( resid   43 and name HG2* )   3.00  1.20  0.50
assign ( resid   43 and name HA   )   ( resid   43 and name HG1* )   4.00  2.20  1.00
assign ( resid   87 and name HA   )   ( resid   87 and name HG   )   4.00  2.20  1.00
assign ( resid   87 and name HA   )   ( resid   87 and name HD1* )   4.00  2.20  1.00
assign ( resid   87 and name HB1  )   ( resid   87 and name HD1* )   4.00  2.20  1.00
assign ( resid   87 and name HB2  )   ( resid   87 and name HD1* )   4.00  2.20  1.00
assign ( resid   87 and name HA   )   ( resid   87 and name HD2* )   4.00  2.20  1.00
assign ( resid   87 and name HB1  )   ( resid   87 and name HD2* )   4.00  2.20  1.00
assign ( resid   87 and name HB2  )   ( resid   87 and name HD2* )   4.00  2.20  1.00
assign ( resid   66 and name HA   )   ( resid   66 and name HG2* )   3.00  1.20  0.50
assign ( resid   66 and name HG2* )   ( resid   67 and name HN   )   4.00  2.20  1.00
assign ( resid   66 and name HG2* )   ( resid   66 and name HG12 )   3.00  1.20  0.50
assign ( resid   66 and name HA   )   ( resid   66 and name HD1* )   4.00  2.20  2.00
assign ( resid   66 and name HB   )   ( resid   66 and name HD1* )   4.00  2.20  1.00
assign ( resid   66 and name HG2* )   ( resid   66 and name HD1* )   3.00  1.20  0.50
assign ( resid   12 and name HA   )   ( resid   12 and name HG*  )   4.00  2.20  1.00
assign ( resid   12 and name HA   )   ( resid   12 and name HD*  )   4.00  2.20  1.00
assign ( resid   12 and name HB2  )   ( resid   12 and name HG*  )   2.00  0.20  0.70
assign ( resid   12 and name HB2  )   ( resid   12 and name HD*  )   3.00  1.20  0.50
assign ( resid   12 and name HB1  )   ( resid   12 and name HD*  )   4.00  2.20  1.00
assign ( resid   65 and name HA   )   ( resid   65 and name HG12 )   4.00  2.20  1.00
assign ( resid   65 and name HA   )   ( resid   65 and name HG11 )   4.00  2.20  1.00
assign ( resid   19 and name HB1  )   ( resid   98 and name HG11 )   4.00  2.20  1.00
assign ( resid   65 and name HG11 )   ( resid   66 and name HN   )   4.00  2.20  2.00
assign ( resid   64 and name HB2  )   ( resid   65 and name HG11 )   4.00  2.20  2.00
assign ( resid   11 and name HG2* )   ( resid   65 and name HG11 )   4.00  2.20  1.00
assign ( resid   65 and name HA   )   ( resid   65 and name HG2* )   4.00  2.20  1.00
assign ( resid   65 and name HG2* )   ( resid   65 and name HG12 )   4.00  2.20  1.00
assign ( resid   65 and name HG2* )   ( resid   65 and name HG11 )   3.00  1.20  0.50
assign ( resid   65 and name HG2* )   ( resid   65 and name HD1* )   3.00  1.20  0.50
assign ( resid   65 and name HD1* )   ( resid   66 and name HN   )   4.00  2.20  2.00
assign ( resid   65 and name HA   )   ( resid   65 and name HD1* )   4.00  2.20  1.00
assign ( resid   11 and name HG12 )   ( resid   65 and name HD1* )   4.00  2.20  1.00
assign ( resid   65 and name HB   )   ( resid   65 and name HD1* )   4.00  2.20  1.00
assign ( resid   11 and name HG2* )   ( resid   65 and name HD1* )   3.00  1.20  0.50
assign ( resid   91 and name HB1  )   ( resid   91 and name HE*  )   3.00  1.20  0.50
assign ( resid   13 and name HA   )   ( resid   13 and name HG2* )   3.00  1.20  0.50
assign ( resid   36 and name HA   )   ( resid   36 and name HG11 )   4.00  2.20  1.00
assign ( resid   36 and name HA   )   ( resid   36 and name HD1* )   4.00  2.20  1.00
assign ( resid   36 and name HB   )   ( resid   37 and name HN   )   4.00  2.20  1.00
assign ( resid   14 and name HG2* )   ( resid   37 and name HN   )   4.00  2.20  2.00
assign ( resid   36 and name HA   )   ( resid   36 and name HG2* )   4.00  2.20  1.00
assign ( resid   14 and name HG2* )   ( resid   36 and name HG11 )   4.00  2.20  1.00
assign ( resid   36 and name HB   )   ( resid   36 and name HD1* )   3.00  1.20  0.50
assign ( resid   14 and name HG2* )   ( resid   36 and name HD1* )   4.00  2.20  1.00
assign ( resid   36 and name HG2* )   ( resid   36 and name HD1* )   4.00  2.20  1.00
assign ( resid   80 and name HA   )   ( resid   80 and name HG1* )   3.00  1.20  0.50
assign ( resid   80 and name HA   )   ( resid   80 and name HG2* )   3.00  1.20  0.50
assign ( resid   80 and name HG1* )   ( resid   81 and name HN   )   4.00  2.20  1.00
assign ( resid  100 and name HA   )   ( resid  100 and name HG2  )   4.00  2.20  1.00
assign ( resid  100 and name HB2  )   ( resid  100 and name HD*  )   4.00  2.20  1.00
assign ( resid  100 and name HA   )   ( resid  100 and name HG1  )   4.00  2.20  1.00
assign ( resid  100 and name HA   )   ( resid  100 and name HD*  )   3.00  1.20  0.50
assign ( resid  100 and name HB1  )   ( resid  100 and name HD*  )   4.00  2.20  1.00
assign ( resid   38 and name HA   )   ( resid   38 and name HD1  )   4.00  2.20  1.00
assign ( resid   38 and name HA   )   ( resid   38 and name HD2  )   3.00  1.20  0.50
assign ( resid    6 and name HA   )   ( resid    6 and name HB*  )   3.00  1.20  0.50
assign ( resid    6 and name HA   )   ( resid    6 and name HD*  )   4.00  2.20  1.00
assign ( resid    6 and name HB*  )   ( resid    6 and name HD*  )   3.00  1.20  0.50
assign ( resid   32 and name HA   )   ( resid   32 and name HG2* )   3.00  1.20  0.50
assign ( resid   32 and name HA   )   ( resid   32 and name HG1* )   3.00  1.20  0.50
assign ( resid   52 and name HA   )   ( resid   52 and name HG2  )   4.00  2.20  1.00
assign ( resid   52 and name HA   )   ( resid   52 and name HD2  )   4.00  2.20  1.00
assign ( resid   52 and name HA   )   ( resid   52 and name HG1  )   4.00  2.20  1.00
assign ( resid   52 and name HG1  )   ( resid   52 and name HE1  )   4.00  2.20  1.00
assign ( resid   52 and name HA   )   ( resid   52 and name HD1  )   4.00  2.20  1.00
assign ( resid   52 and name HB1  )   ( resid   52 and name HD1  )   4.00  2.20  1.00
assign ( resid   52 and name HB2  )   ( resid   52 and name HD1  )   4.00  2.20  1.00
assign ( resid   52 and name HB1  )   ( resid   52 and name HD2  )   4.00  2.20  1.00
assign ( resid   52 and name HB2  )   ( resid   52 and name HD2  )   4.00  2.20  1.00
assign ( resid   52 and name HB1  )   ( resid   52 and name HE1  )   4.00  2.20  1.00
assign ( resid   52 and name HB2  )   ( resid   52 and name HE1  )   4.00  2.20  1.00
assign ( resid   52 and name HG2  )   ( resid   52 and name HE1  )   4.00  2.20  1.00
assign ( resid   52 and name HB1  )   ( resid   52 and name HE2  )   4.00  2.20  1.00
assign ( resid   52 and name HB2  )   ( resid   52 and name HE2  )   4.00  2.20  1.00
assign ( resid   52 and name HG2  )   ( resid   52 and name HE2  )   4.00  2.20  1.00
assign ( resid   91 and name HA   )   ( resid   91 and name HG1  )   4.00  2.20  1.00
assign ( resid   91 and name HA   )   ( resid   91 and name HG2  )   4.00  2.20  1.00
assign ( resid  102 and name HA   )   ( resid  102 and name HG1* )   4.00  2.20  1.00
assign ( resid   32 and name HA   )   ( resid  102 and name HG1* )   4.00  2.20  1.00
assign ( resid   32 and name HA   )   ( resid  102 and name HG2* )   4.00  2.20  1.00
assign ( resid  102 and name HA   )   ( resid  102 and name HG2* )   4.00  2.20  1.00
assign ( resid   52 and name HG1  )   ( resid   52 and name HE2  )   4.00  2.20  1.00
assign ( resid   70 and name HB1  )   ( resid   71 and name HD1  )   4.00  2.20  1.00
assign ( resid   70 and name HB1  )   ( resid   71 and name HD2  )   4.00  2.20  1.00
assign ( resid   98 and name HA   )   ( resid   98 and name HG11 )   4.00  2.20  1.00
assign ( resid   98 and name HA   )   ( resid   98 and name HG12 )   4.00  2.20  1.00
assign ( resid   98 and name HA   )   ( resid   98 and name HG2* )   3.00  1.20  0.50
assign ( resid   98 and name HG2* )   ( resid   98 and name HG11 )   3.00  1.20  0.50
assign ( resid   98 and name HG2* )   ( resid   98 and name HG12 )   3.00  1.20  0.50
assign ( resid   98 and name HG2* )   ( resid   98 and name HD1* )   3.00  1.20  0.50
assign ( resid   98 and name HA   )   ( resid   98 and name HD1* )   4.00  2.20  1.00
assign ( resid   98 and name HB   )   ( resid   98 and name HD1* )   3.00  1.20  0.50
assign ( resid   22 and name HA   )   ( resid   22 and name HG1  )   4.00  2.20  1.00
assign ( resid   22 and name HA   )   ( resid   22 and name HG2  )   4.00  2.20  1.00
assign ( resid   15 and name HA   )   ( resid   16 and name HD1  )   3.00  1.20  0.50
assign ( resid   15 and name HA   )   ( resid   15 and name HG2* )   3.00  1.20  0.50
assign ( resid   92 and name HA   )   ( resid   93 and name HD1  )   3.00  1.20  0.50
assign ( resid   92 and name HA   )   ( resid   92 and name HG2* )   3.00  1.20  0.50
assign ( resid   35 and name HA   )   ( resid   69 and name HB2  )   4.00  2.20  1.00
assign ( resid   34 and name HA   )   ( resid   34 and name HG   )   4.00  2.20  1.00
assign ( resid   34 and name HA   )   ( resid   34 and name HD1* )   4.00  2.20  1.00
assign ( resid   34 and name HB2  )   ( resid   34 and name HD1* )   4.00  2.20  1.00
assign ( resid   34 and name HB1  )   ( resid   34 and name HD1* )   4.00  2.20  1.00
assign ( resid   34 and name HA   )   ( resid   34 and name HD2* )   4.00  2.20  1.00
assign ( resid   34 and name HB2  )   ( resid   34 and name HD2* )   4.00  2.20  1.00
assign ( resid   34 and name HB1  )   ( resid   34 and name HD2* )   4.00  2.20  1.00
assign ( resid   20 and name HA1  )   ( resid   25 and name HD1* )   4.00  2.20  1.00
assign ( resid   20 and name HA2  )   ( resid   34 and name HB1  )   4.00  2.20  1.00
assign ( resid   20 and name HA2  )   ( resid   34 and name HD1* )   4.00  2.20  1.00
assign ( resid   20 and name HA1  )   ( resid   34 and name HD1* )   4.00  2.20  1.00
assign ( resid   77 and name HH2  )   ( resid   82 and name HA   )   4.00  2.20  1.00
assign ( resid   30 and name HA   )   ( resid  101 and name HE2  )   4.00  2.20  1.00
assign ( resid   30 and name HA   )   ( resid   31 and name HE3  )   4.00  2.20  1.00
assign ( resid   30 and name HB*  )   ( resid  101 and name HE1  )   4.00  2.20  2.00
assign ( resid   30 and name HB*  )   ( resid  101 and name HE2  )   4.00  2.20  2.00
assign ( resid   30 and name HB*  )   ( resid  101 and name HD1  )   4.00  2.20  2.00
assign ( resid   30 and name HB*  )   ( resid  101 and name HD2  )   4.00  2.20  2.00
assign ( resid   30 and name HB*  )   ( resid  101 and name HB1  )   4.00  2.20  2.00
assign ( resid   29 and name HA   )   ( resid   30 and name HD2  )   4.00  2.20  1.00
assign ( resid   74 and name HA2  )   ( resid   91 and name HB2  )   4.00  2.20  1.00
assign ( resid   74 and name HA1  )   ( resid   91 and name HB1  )   4.00  2.20  1.00
assign ( resid   74 and name HA2  )   ( resid   91 and name HE*  )   4.00  2.20  1.00
assign ( resid   74 and name HA1  )   ( resid   91 and name HE*  )   4.00  2.20  1.00
assign ( resid   51 and name HB2  )   ( resid   51 and name HE1  )   4.00  2.20  2.00
assign ( resid   51 and name HB1  )   ( resid   51 and name HE1  )   4.00  2.20  2.00
assign ( resid   51 and name HA   )   ( resid   51 and name HE1  )   4.00  2.20  2.00
assign ( resid   14 and name HG1* )   ( resid   41 and name HA2  )   4.00  2.20  2.00
assign ( resid   25 and name HA   )   ( resid   31 and name HZ3  )   4.00  2.20  1.00
assign ( resid   20 and name HA1  )   ( resid   25 and name HD2* )   4.00  2.20  1.00
assign ( resid   22 and name HA   )   ( resid   25 and name HD2* )   4.00  2.20  1.00
assign ( resid   17 and name HA   )   ( resid   18 and name HB*  )   4.00  2.20  1.00
assign ( resid   17 and name HB1  )   ( resid   42 and name HA   )   4.00  2.20  1.00
assign ( resid   17 and name HB2  )   ( resid   42 and name HA   )   4.00  2.20  1.00
assign ( resid    8 and name HG1* )   ( resid    9 and name HA   )   4.00  2.20  1.00
assign ( resid   60 and name HA   )   ( resid   61 and name HG2* )   4.00  2.20  2.00
assign ( resid   60 and name HB*  )   ( resid   61 and name HG2* )   3.00  1.20  0.50
assign ( resid   19 and name HD2* )   ( resid   96 and name HA2  )   4.00  2.20  1.00
assign ( resid   19 and name HD2* )   ( resid   97 and name HD*  )   4.00  2.20  1.00
assign ( resid   23 and name HA   )   ( resid   26 and name HB*  )   4.00  2.20  1.00
assign ( resid   23 and name HA   )   ( resid   26 and name HG1  )   4.00  2.20  2.00
assign ( resid   23 and name HA   )   ( resid   26 and name HG2  )   4.00  2.20  1.00
assign ( resid   23 and name HA   )   ( resid   26 and name HE*  )   4.00  2.20  2.00
assign ( resid   26 and name HE*  )   ( resid   27 and name HA   )   4.00  2.20  2.00
assign ( resid  101 and name HA   )   ( resid  101 and name HD1  )   4.00  2.20  1.00
assign ( resid   42 and name HA   )   ( resid   43 and name HG2* )   4.00  2.20  2.00
assign ( resid   77 and name HA   )   ( resid   85 and name HN   )   4.00  2.20  1.00
assign ( resid   77 and name HA   )   ( resid   77 and name HE3  )   4.00  2.20  1.00
assign ( resid   77 and name HA   )   ( resid   84 and name HA   )   4.00  2.20  1.00
assign ( resid   77 and name HA   )   ( resid   84 and name HG*  )   4.00  2.20  1.00
assign ( resid   75 and name HE3  )   ( resid   77 and name HB1  )   4.00  2.20  2.00
assign ( resid   75 and name HZ3  )   ( resid   77 and name HB2  )   4.00  2.20  1.00
assign ( resid   66 and name HG11 )   ( resid   77 and name HB2  )   4.00  2.20  1.00
assign ( resid    7 and name HA   )   ( resid   65 and name HD1* )   4.00  2.20  1.00
assign ( resid   36 and name HG2* )   ( resid   69 and name HA   )   4.00  2.20  1.00
assign ( resid   36 and name HN   )   ( resid   69 and name HB1  )   4.00  2.20  2.00
assign ( resid   36 and name HG2* )   ( resid   69 and name HB1  )   4.00  2.20  2.00
assign ( resid   36 and name HG2* )   ( resid   69 and name HB2  )   4.00  2.20  1.00
assign ( resid   36 and name HB   )   ( resid   69 and name HB1  )   4.00  2.20  1.00
assign ( resid   35 and name HA   )   ( resid   68 and name HA1  )   4.00  2.20  1.00
assign ( resid   14 and name HG1* )   ( resid   39 and name HA   )   3.00  1.20  0.50
assign ( resid   12 and name HG*  )   ( resid   39 and name HA   )   4.00  2.20  1.00
assign ( resid   14 and name HB   )   ( resid   39 and name HA   )   4.00  2.20  2.00
assign ( resid   38 and name HB2  )   ( resid   39 and name HA   )   4.00  2.20  2.00
assign ( resid   39 and name HB   )   ( resid   63 and name HB*  )   4.00  2.20  1.00
assign ( resid   39 and name HG2* )   ( resid   63 and name HE1  )   4.00  2.20  1.00
assign ( resid   39 and name HG2* )   ( resid   63 and name HD2  )   4.00  2.20  1.00
assign ( resid   39 and name HG2* )   ( resid   40 and name HA   )   4.00  2.20  1.00
assign ( resid   39 and name HA   )   ( resid   39 and name HG2* )   3.00  1.20  0.50
assign ( resid   39 and name HG2* )   ( resid   40 and name HB1  )   4.00  2.20  1.00
assign ( resid   39 and name HG2* )   ( resid   40 and name HB2  )   4.00  2.20  1.00
assign ( resid   71 and name HA   )   ( resid   72 and name HD*  )   3.00  1.20  0.50
assign ( resid   70 and name HA   )   ( resid   72 and name HD*  )   4.00  2.20  1.00
assign ( resid   71 and name HB1  )   ( resid   72 and name HD*  )   4.00  2.20  1.00
assign ( resid   71 and name HB2  )   ( resid   72 and name HD*  )   4.00  2.20  1.00
assign ( resid    8 and name HA   )   ( resid   11 and name HG12 )   4.00  2.20  1.00
assign ( resid    8 and name HA   )   ( resid   65 and name HG2* )   4.00  2.20  1.00
assign ( resid    8 and name HA   )   ( resid   65 and name HD1* )   3.00  1.20  0.50
assign ( resid    8 and name HB   )   ( resid   11 and name HD1* )   4.00  2.20  1.00
assign ( resid    8 and name HG1* )   ( resid   85 and name HE1  )   4.00  2.20  1.00
assign ( resid    8 and name HG2* )   ( resid   85 and name HE1  )   4.00  2.20  1.00
assign ( resid    8 and name HG2* )   ( resid    9 and name HA   )   4.00  2.20  1.00
assign ( resid   80 and name HG2* )   ( resid   81 and name HA   )   4.00  2.20  1.00
assign ( resid   81 and name HA   )   ( resid   83 and name HG2* )   4.00  2.20  1.00
assign ( resid   78 and name HB2  )   ( resid   81 and name HB1  )   4.00  2.20  1.00
assign ( resid   76 and name HA1  )   ( resid   84 and name HG*  )   4.00  2.20  2.00
assign ( resid   76 and name HA1  )   ( resid   87 and name HD1* )   4.00  2.20  1.00
assign ( resid   78 and name HB2  )   ( resid   81 and name HB2  )   4.00  2.20  1.00
assign ( resid   57 and name HA   )   ( resid   60 and name HB*  )   3.00  1.20  0.50
assign ( resid   57 and name HA   )   ( resid   61 and name HG2* )   4.00  2.20  1.00
assign ( resid   49 and name HB1  )   ( resid   50 and name HD1  )   4.00  2.20  1.00
assign ( resid   49 and name HB2  )   ( resid   50 and name HD1  )   4.00  2.20  1.00
assign ( resid   49 and name HA   )   ( resid   50 and name HD2  )   4.00  2.20  1.00
assign ( resid   49 and name HB2  )   ( resid   50 and name HD2  )   4.00  2.20  1.00
assign ( resid   49 and name HB1  )   ( resid   50 and name HD2  )   4.00  2.20  1.00
assign ( resid   20 and name HA2  )   ( resid   21 and name HA   )   4.00  2.20  1.00
assign ( resid   21 and name HB1  )   ( resid   31 and name HB1  )   4.00  2.20  2.00
assign ( resid   21 and name HB2  )   ( resid   31 and name HB1  )   4.00  2.20  2.00
assign ( resid   21 and name HB2  )   ( resid   24 and name HB2  )   4.00  2.20  2.00
assign ( resid   24 and name HB2  )   ( resid   25 and name HG   )   4.00  2.20  2.00
assign ( resid   21 and name HB1  )   ( resid   24 and name HB2  )   4.00  2.20  2.00
assign ( resid   99 and name HB1  )   ( resid  101 and name HE1  )   4.00  2.20  2.00
assign ( resid   99 and name HB1  )   ( resid  101 and name HE2  )   4.00  2.20  2.00
assign ( resid   99 and name HB2  )   ( resid  101 and name HE1  )   4.00  2.20  2.00
assign ( resid   99 and name HB2  )   ( resid  101 and name HE2  )   4.00  2.20  2.00
assign ( resid   98 and name HG2* )   ( resid   99 and name HG1  )   4.00  2.20  1.00
assign ( resid   98 and name HA   )   ( resid   99 and name HG1  )   4.00  2.20  1.00
assign ( resid   31 and name HH2  )   ( resid   99 and name HG1  )   4.00  2.20  1.00
assign ( resid   31 and name HZ2  )   ( resid   99 and name HD2  )   4.00  2.20  1.00
assign ( resid   58 and name HA   )   ( resid   58 and name HD1  )   4.00  2.20  2.00
assign ( resid   58 and name HA   )   ( resid   58 and name HD2  )   4.00  2.20  2.00
assign ( resid   58 and name HA   )   ( resid   79 and name HD2  )   4.00  2.20  1.00
assign ( resid   58 and name HA   )   ( resid   63 and name HB*  )   4.00  2.20  1.00
assign ( resid   58 and name HB1  )   ( resid   79 and name HE2  )   4.00  2.20  2.00
assign ( resid   58 and name HB1  )   ( resid   79 and name HD2  )   4.00  2.20  2.00
assign ( resid   58 and name HB2  )   ( resid   79 and name HE2  )   4.00  2.20  2.00
assign ( resid   55 and name HB   )   ( resid   58 and name HB1  )   4.00  2.20  1.00
assign ( resid   55 and name HB   )   ( resid   58 and name HB2  )   4.00  2.20  2.00
assign ( resid   26 and name HG2  )   ( resid   27 and name HA   )   4.00  2.20  2.00
assign ( resid   26 and name HD*  )   ( resid   27 and name HA   )   4.00  2.20  2.00
assign ( resid   18 and name HA   )   ( resid   19 and name HG   )   4.00  2.20  2.00
assign ( resid   26 and name HA   )   ( resid   27 and name HG2* )   4.00  2.20  2.00
assign ( resid   26 and name HB*  )   ( resid   27 and name HG2* )   4.00  2.20  1.00
assign ( resid   26 and name HG2  )   ( resid   27 and name HG2* )   4.00  2.20  1.00
assign ( resid   26 and name HD*  )   ( resid   27 and name HG2* )   4.00  2.20  1.00
assign ( resid   27 and name HD1* )   ( resid   29 and name HB2  )   4.00  2.20  1.00
assign ( resid   24 and name HA   )   ( resid   27 and name HD1* )   4.00  2.20  1.00
assign ( resid   27 and name HD1* )   ( resid   29 and name HB1  )   4.00  2.20  1.00
assign ( resid   23 and name HG*  )   ( resid   27 and name HD1* )   4.00  2.20  1.00
assign ( resid   35 and name HD1  )   ( resid   46 and name HA   )   4.00  2.20  2.00
assign ( resid   35 and name HB*  )   ( resid   46 and name HA   )   4.00  2.20  1.00
assign ( resid   46 and name HA   )   ( resid   54 and name HB*  )   4.00  2.20  1.00
assign ( resid   16 and name HA   )   ( resid   92 and name HG2* )   4.00  2.20  2.00
assign ( resid   15 and name HG2* )   ( resid   16 and name HA   )   4.00  2.20  2.00
assign ( resid   16 and name HA   )   ( resid   36 and name HG11 )   4.00  2.20  2.00
assign ( resid   16 and name HA   )   ( resid   43 and name HG2* )   4.00  2.20  1.00
assign ( resid   14 and name HG2* )   ( resid   16 and name HA   )   4.00  2.20  1.00
assign ( resid   96 and name HA2  )   ( resid   97 and name HD*  )   3.00  1.20  0.50
assign ( resid   96 and name HA1  )   ( resid   97 and name HD*  )   3.00  1.20  0.50
assign ( resid   19 and name HD1* )   ( resid   97 and name HD*  )   4.00  2.20  1.00
assign ( resid   87 and name HD2* )   ( resid   90 and name HB1  )   4.00  2.20  2.00
assign ( resid   87 and name HA   )   ( resid   90 and name HG1  )   4.00  2.20  1.00
assign ( resid   87 and name HA   )   ( resid   90 and name HD*  )   4.00  2.20  1.00
assign ( resid   34 and name HA   )   ( resid   45 and name HA   )   4.00  2.20  1.00
assign ( resid   31 and name HA   )   ( resid   45 and name HB1  )   4.00  2.20  1.00
assign ( resid   31 and name HB1  )   ( resid   45 and name HB2  )   4.00  2.20  1.00
assign ( resid   31 and name HB1  )   ( resid   45 and name HB1  )   4.00  2.20  1.00
assign ( resid   31 and name HB2  )   ( resid   45 and name HB1  )   4.00  2.20  1.00
assign ( resid   31 and name HB2  )   ( resid   45 and name HB2  )   4.00  2.20  1.00
assign ( resid   77 and name HD1  )   ( resid   79 and name HA   )   4.00  2.20  1.00
assign ( resid   79 and name HA   )   ( resid   82 and name HA   )   4.00  2.20  1.00
assign ( resid   79 and name HA   )   ( resid   79 and name HD1  )   4.00  2.20  1.00
assign ( resid   79 and name HB2  )   ( resid   79 and name HE2  )   4.00  2.20  1.00
assign ( resid   79 and name HB1  )   ( resid   79 and name HE1  )   4.00  2.20  2.00
assign ( resid   73 and name HA   )   ( resid   75 and name HD1  )   4.00  2.20  1.00
assign ( resid   14 and name HG1* )   ( resid   40 and name HA   )   4.00  2.20  1.00
assign ( resid   40 and name HB2  )   ( resid   61 and name HG2* )   4.00  2.20  1.00
assign ( resid   40 and name HB1  )   ( resid   61 and name HG2* )   4.00  2.20  1.00
assign ( resid   56 and name HA   )   ( resid   58 and name HN   )   4.00  2.20  1.00
assign ( resid   56 and name HA   )   ( resid   59 and name HB*  )   4.00  2.20  1.00
assign ( resid   56 and name HA   )   ( resid   60 and name HB*  )   4.00  2.20  2.00
assign ( resid   53 and name HA   )   ( resid   56 and name HB1  )   4.00  2.20  1.00
assign ( resid   53 and name HD2  )   ( resid   56 and name HD*  )   4.00  2.20  1.00
assign ( resid   53 and name HD2  )   ( resid   56 and name HB1  )   4.00  2.20  2.00
assign ( resid   53 and name HA   )   ( resid   56 and name HD*  )   4.00  2.20  1.00
assign ( resid   55 and name HB   )   ( resid   58 and name HN   )   4.00  2.20  2.00
assign ( resid   55 and name HB   )   ( resid   79 and name HE1  )   4.00  2.20  2.00
assign ( resid   55 and name HG2* )   ( resid   79 and name HE1  )   4.00  2.20  1.00
assign ( resid   52 and name HA   )   ( resid   55 and name HG2* )   4.00  2.20  1.00
assign ( resid   52 and name HB1  )   ( resid   55 and name HG2* )   4.00  2.20  1.00
assign ( resid   52 and name HB2  )   ( resid   55 and name HG2* )   4.00  2.20  1.00
assign ( resid   55 and name HG2* )   ( resid   66 and name HD1* )   4.00  2.20  2.00
assign ( resid   54 and name HB*  )   ( resid   55 and name HG2* )   4.00  2.20  1.00
assign ( resid   16 and name HB1  )   ( resid   43 and name HG2* )   4.00  2.20  1.00
assign ( resid   15 and name HG2* )   ( resid   16 and name HD1  )   4.00  2.20  1.00
assign ( resid   60 and name HB*  )   ( resid   61 and name HA   )   4.00  2.20  1.00
assign ( resid   61 and name HB   )   ( resid   63 and name HE1  )   4.00  2.20  1.00
assign ( resid   61 and name HB   )   ( resid   63 and name HD2  )   4.00  2.20  1.00
assign ( resid   11 and name HA   )   ( resid   38 and name HB1  )   4.00  2.20  1.00
assign ( resid   11 and name HA   )   ( resid   38 and name HB2  )   4.00  2.20  1.00
assign ( resid   11 and name HB   )   ( resid   38 and name HB1  )   4.00  2.20  1.00
assign ( resid    8 and name HA   )   ( resid   11 and name HB   )   4.00  2.20  2.00
assign ( resid   36 and name HG11 )   ( resid   41 and name HA2  )   4.00  2.20  1.00
assign ( resid   11 and name HG2* )   ( resid   38 and name HA   )   4.00  2.20  1.00
assign ( resid   11 and name HG2* )   ( resid   38 and name HD1  )   4.00  2.20  2.00
assign ( resid    8 and name HA   )   ( resid   11 and name HG2* )   4.00  2.20  1.00
assign ( resid   11 and name HG2* )   ( resid   38 and name HB1  )   3.00  1.20  0.50
assign ( resid   11 and name HD1* )   ( resid   38 and name HE   )   4.00  2.20  1.00
assign ( resid   11 and name HD1* )   ( resid   85 and name HD1  )   4.00  2.20  2.00
assign ( resid    8 and name HA   )   ( resid   11 and name HD1* )   3.00  1.20  0.50
assign ( resid   11 and name HD1* )   ( resid   90 and name HD*  )   4.00  2.20  1.00
assign ( resid   11 and name HD1* )   ( resid   38 and name HB1  )   4.00  2.20  1.00
assign ( resid   11 and name HD1* )   ( resid   65 and name HD1* )   3.00  1.20  0.50
assign ( resid   11 and name HD1* )   ( resid   87 and name HD1* )   4.00  2.20  1.00
assign ( resid    8 and name HG2* )   ( resid   11 and name HD1* )   3.00  1.20  0.50
assign ( resid    8 and name HG1* )   ( resid   11 and name HD1* )   3.00  1.20  0.50
assign ( resid    2 and name HG2* )   ( resid   83 and name HB   )   4.00  2.20  1.00
assign ( resid    2 and name HG2* )   ( resid   83 and name HG1* )   3.00  1.20  0.50
assign ( resid   24 and name HA   )   ( resid   27 and name HB   )   4.00  2.20  2.00
assign ( resid   24 and name HA   )   ( resid   27 and name HG12 )   4.00  2.20  1.00
assign ( resid   24 and name HA   )   ( resid   27 and name HG11 )   4.00  2.20  1.00
assign ( resid   24 and name HA   )   ( resid   27 and name HG2* )   4.00  2.20  1.00
assign ( resid   24 and name HB1  )   ( resid   31 and name HE3  )   4.00  2.20  1.00
assign ( resid   21 and name HB1  )   ( resid   24 and name HB1  )   4.00  2.20  2.00
assign ( resid   21 and name HB2  )   ( resid   24 and name HB1  )   4.00  2.20  2.00
assign ( resid   24 and name HB1  )   ( resid   25 and name HG   )   4.00  2.20  2.00
assign ( resid   82 and name HA   )   ( resid   83 and name HA   )   4.00  2.20  1.00
assign ( resid    2 and name HG2* )   ( resid   83 and name HA   )   4.00  2.20  1.00
assign ( resid   77 and name HZ3  )   ( resid   83 and name HA   )   4.00  2.20  1.00
assign ( resid   83 and name HB   )   ( resid   84 and name HA   )   4.00  2.20  2.00
assign ( resid   83 and name HN   )   ( resid   83 and name HG1* )   4.00  2.20  1.00
assign ( resid   36 and name HD1* )   ( resid   43 and name HG2* )   3.00  1.20  0.50
assign ( resid   16 and name HG1  )   ( resid   43 and name HG2* )   4.00  2.20  2.00
assign ( resid   16 and name HB2  )   ( resid   43 and name HG2* )   4.00  2.20  1.00
assign ( resid   81 and name HB2  )   ( resid   83 and name HG1* )   4.00  2.20  1.00
assign ( resid   81 and name HB1  )   ( resid   83 and name HG1* )   4.00  2.20  1.00
assign ( resid   21 and name HA   )   ( resid   43 and name HG2* )   4.00  2.20  2.00
assign ( resid   81 and name HA   )   ( resid   83 and name HG1* )   4.00  2.20  1.00
assign ( resid   36 and name HA   )   ( resid   43 and name HG2* )   4.00  2.20  1.00
assign ( resid   83 and name HG2* )   ( resid   85 and name HE2  )   4.00  2.20  1.00
assign ( resid   83 and name HN   )   ( resid   83 and name HG2* )   3.00  1.20  0.50
assign ( resid   81 and name HB1  )   ( resid   83 and name HG2* )   4.00  2.20  1.00
assign ( resid   78 and name HB2  )   ( resid   83 and name HG2* )   3.00  1.20  0.50
assign ( resid   81 and name HB2  )   ( resid   83 and name HG2* )   4.00  2.20  1.00
assign ( resid    2 and name HG2* )   ( resid   83 and name HG2* )   4.00  2.20  1.00
assign ( resid   49 and name HA   )   ( resid   50 and name HD1  )   4.00  2.20  1.00
assign ( resid   15 and name HA   )   ( resid   92 and name HG2* )   4.00  2.20  1.00
assign ( resid   14 and name HB   )   ( resid   41 and name HA2  )   4.00  2.20  1.00
assign ( resid   14 and name HG1* )   ( resid   41 and name HA1  )   4.00  2.20  1.00
assign ( resid   14 and name HG1* )   ( resid   38 and name HB1  )   4.00  2.20  1.00
assign ( resid   12 and name HG*  )   ( resid   14 and name HG1* )   3.00  1.20  0.50
assign ( resid   14 and name HG2* )   ( resid   41 and name HA1  )   4.00  2.20  1.00
assign ( resid   13 and name HA   )   ( resid   14 and name HG2* )   4.00  2.20  1.00
assign ( resid   14 and name HG2* )   ( resid   39 and name HA   )   4.00  2.20  1.00
assign ( resid   14 and name HG2* )   ( resid   16 and name HD1  )   4.00  2.20  1.00
assign ( resid   14 and name HG2* )   ( resid   41 and name HA2  )   4.00  2.20  1.00
assign ( resid   14 and name HG2* )   ( resid   92 and name HG2* )   4.00  2.20  1.00
assign ( resid   36 and name HG2* )   ( resid   92 and name HG2* )   4.00  2.20  1.00
assign ( resid   75 and name HA   )   ( resid   86 and name HA   )   4.00  2.20  1.00
assign ( resid   75 and name HB1  )   ( resid   86 and name HA   )   4.00  2.20  1.00
assign ( resid    1 and name HB*  )   ( resid   86 and name HA   )   4.00  2.20  2.00
assign ( resid    1 and name HA   )   ( resid   85 and name HA   )   4.00  2.20  1.00
assign ( resid   77 and name HE3  )   ( resid   84 and name HA   )   4.00  2.20  1.00
assign ( resid   78 and name HN   )   ( resid   84 and name HA   )   4.00  2.20  1.00
assign ( resid   84 and name HA   )   ( resid   85 and name HD2  )   4.00  2.20  1.00
assign ( resid   77 and name HZ3  )   ( resid   84 and name HA   )   4.00  2.20  2.00
assign ( resid   77 and name HE3  )   ( resid   84 and name HB*  )   4.00  2.20  1.00
assign ( resid   77 and name HZ3  )   ( resid   84 and name HB*  )   4.00  2.20  1.00
assign ( resid   83 and name HA   )   ( resid   84 and name HB*  )   4.00  2.20  1.00
assign ( resid   83 and name HG2* )   ( resid   84 and name HB*  )   4.00  2.20  1.00
assign ( resid   75 and name HB2  )   ( resid   84 and name HB*  )   4.00  2.20  2.00
assign ( resid   77 and name HE3  )   ( resid   84 and name HG*  )   4.00  2.20  1.00
assign ( resid   77 and name HZ3  )   ( resid   84 and name HG*  )   4.00  2.20  1.00
assign ( resid   75 and name HB2  )   ( resid   84 and name HG*  )   4.00  2.20  1.00
assign ( resid   75 and name HB1  )   ( resid   84 and name HG*  )   4.00  2.20  1.00
assign ( resid   58 and name HD1  )   ( resid   64 and name HA   )   4.00  2.20  1.00
assign ( resid   58 and name HD2  )   ( resid   64 and name HA   )   4.00  2.20  1.00
assign ( resid   64 and name HA   )   ( resid   79 and name HD2  )   4.00  2.20  1.00
assign ( resid   64 and name HA   )   ( resid   79 and name HB1  )   4.00  2.20  1.00
assign ( resid   64 and name HB1  )   ( resid   80 and name HG1* )   4.00  2.20  1.00
assign ( resid   64 and name HB1  )   ( resid   65 and name HD1* )   4.00  2.20  2.00
assign ( resid   64 and name HB2  )   ( resid   65 and name HD1* )   4.00  2.20  1.00
assign ( resid    7 and name HB1  )   ( resid   64 and name HG*  )   4.00  2.20  1.00
assign ( resid    7 and name HB2  )   ( resid   64 and name HG*  )   4.00  2.20  1.00
assign ( resid   63 and name HD2  )   ( resid   64 and name HD1  )   4.00  2.20  1.00
assign ( resid   63 and name HD2  )   ( resid   64 and name HD2  )   4.00  2.20  1.00
assign ( resid   63 and name HA   )   ( resid   64 and name HD2  )   4.00  2.20  1.00
assign ( resid   63 and name HA   )   ( resid   64 and name HD1  )   4.00  2.20  1.00
assign ( resid   63 and name HB*  )   ( resid   64 and name HD2  )   4.00  2.20  1.00
assign ( resid   63 and name HB*  )   ( resid   64 and name HD1  )   4.00  2.20  1.00
assign ( resid   37 and name HN   )   ( resid   43 and name HA   )   4.00  2.20  1.00
assign ( resid   34 and name HB1  )   ( resid   43 and name HA   )   4.00  2.20  2.00
assign ( resid   36 and name HG11 )   ( resid   43 and name HA   )   4.00  2.20  2.00
assign ( resid   36 and name HB   )   ( resid   43 and name HA   )   4.00  2.20  1.00
assign ( resid   36 and name HD1* )   ( resid   43 and name HA   )   4.00  2.20  1.00
assign ( resid   21 and name HA   )   ( resid   43 and name HB   )   4.00  2.20  1.00
assign ( resid   22 and name HB*  )   ( resid   43 and name HB   )   4.00  2.20  1.00
assign ( resid   18 and name HB*  )   ( resid   43 and name HB   )   4.00  2.20  1.00
assign ( resid   34 and name HA   )   ( resid   43 and name HG1* )   4.00  2.20  1.00
assign ( resid   21 and name HA   )   ( resid   43 and name HG1* )   4.00  2.20  1.00
assign ( resid   20 and name HA2  )   ( resid   43 and name HG1* )   4.00  2.20  1.00
assign ( resid   34 and name HB2  )   ( resid   43 and name HG1* )   4.00  2.20  1.00
assign ( resid   34 and name HG   )   ( resid   43 and name HG1* )   4.00  2.20  1.00
assign ( resid   34 and name HB1  )   ( resid   43 and name HG1* )   4.00  2.20  1.00
assign ( resid   34 and name HD1* )   ( resid   43 and name HG1* )   4.00  2.20  1.00
assign ( resid   16 and name HG2  )   ( resid   94 and name HA   )   4.00  2.20  2.00
assign ( resid   27 and name HB   )   ( resid   29 and name HA   )   4.00  2.20  2.00
assign ( resid   29 and name HA   )   ( resid   30 and name HG1  )   4.00  2.20  1.00
assign ( resid   94 and name HA   )   ( resid   98 and name HD1* )   4.00  2.20  2.00
assign ( resid   85 and name HE1  )   ( resid   87 and name HA   )   4.00  2.20  1.00
assign ( resid   31 and name HD1  )   ( resid   34 and name HG   )   4.00  2.20  2.00
assign ( resid   85 and name HD1  )   ( resid   87 and name HG   )   4.00  2.20  2.00
assign ( resid   34 and name HG   )   ( resid   70 and name HB2  )   4.00  2.20  1.00
assign ( resid   76 and name HA2  )   ( resid   87 and name HD1* )   4.00  2.20  2.00
assign ( resid   75 and name HA   )   ( resid   87 and name HD1* )   4.00  2.20  1.00
assign ( resid   38 and name HD1  )   ( resid   87 and name HD1* )   4.00  2.20  1.00
assign ( resid   85 and name HE1  )   ( resid   87 and name HD2* )   4.00  2.20  1.00
assign ( resid   75 and name HA   )   ( resid   87 and name HD2* )   4.00  2.20  1.00
assign ( resid   38 and name HD1  )   ( resid   87 and name HD2* )   4.00  2.20  1.00
assign ( resid   87 and name HD2* )   ( resid   91 and name HA   )   4.00  2.20  2.00
assign ( resid   76 and name HA1  )   ( resid   87 and name HD2* )   4.00  2.20  1.00
assign ( resid   14 and name HB   )   ( resid   41 and name HA1  )   4.00  2.20  1.00
assign ( resid   36 and name HG12 )   ( resid   41 and name HA1  )   4.00  2.20  1.00
assign ( resid   36 and name HG12 )   ( resid   41 and name HA2  )   4.00  2.20  1.00
assign ( resid   36 and name HD1* )   ( resid   41 and name HA1  )   4.00  2.20  1.00
assign ( resid   37 and name HA   )   ( resid   66 and name HA   )   4.00  2.20  1.00
assign ( resid   36 and name HG2* )   ( resid   66 and name HA   )   4.00  2.20  2.00
assign ( resid   36 and name HN   )   ( resid   66 and name HB   )   4.00  2.20  1.00
assign ( resid   36 and name HG2* )   ( resid   66 and name HB   )   4.00  2.20  2.00
assign ( resid   36 and name HN   )   ( resid   66 and name HA   )   4.00  2.20  2.00
assign ( resid   66 and name HG12 )   ( resid   79 and name HE2  )   4.00  2.20  1.00
assign ( resid   66 and name HG11 )   ( resid   75 and name HE3  )   4.00  2.20  2.00
assign ( resid   66 and name HG11 )   ( resid   79 and name HE2  )   4.00  2.20  2.00
assign ( resid   66 and name HG12 )   ( resid   77 and name HD1  )   4.00  2.20  1.00
assign ( resid   66 and name HG11 )   ( resid   77 and name HD1  )   4.00  2.20  1.00
assign ( resid   66 and name HG12 )   ( resid   77 and name HB1  )   4.00  2.20  1.00
assign ( resid   66 and name HG11 )   ( resid   77 and name HB1  )   4.00  2.20  1.00
assign ( resid   66 and name HN   )   ( resid   66 and name HG2* )   4.00  2.20  1.00
assign ( resid   66 and name HG2* )   ( resid   77 and name HN   )   4.00  2.20  1.00
assign ( resid   66 and name HG2* )   ( resid   79 and name HD2  )   4.00  2.20  1.00
assign ( resid   66 and name HG2* )   ( resid   79 and name HE2  )   3.00  1.20  0.50
assign ( resid   37 and name HA   )   ( resid   66 and name HG2* )   4.00  2.20  1.00
assign ( resid   58 and name HB2  )   ( resid   66 and name HG2* )   4.00  2.20  2.00
assign ( resid   66 and name HG2* )   ( resid   77 and name HB1  )   4.00  2.20  2.00
assign ( resid   66 and name HD1* )   ( resid   77 and name HN   )   4.00  2.20  1.00
assign ( resid   66 and name HN   )   ( resid   66 and name HD1* )   4.00  2.20  1.00
assign ( resid   66 and name HD1* )   ( resid   79 and name HE2  )   4.00  2.20  1.00
assign ( resid   66 and name HD1* )   ( resid   75 and name HZ3  )   4.00  2.20  1.00
assign ( resid   66 and name HD1* )   ( resid   75 and name HH2  )   4.00  2.20  1.00
assign ( resid   66 and name HD1* )   ( resid   77 and name HD1  )   4.00  2.20  1.00
assign ( resid   35 and name HA   )   ( resid   66 and name HD1* )   4.00  2.20  1.00
assign ( resid   35 and name HD2  )   ( resid   66 and name HD1* )   4.00  2.20  1.00
assign ( resid   66 and name HD1* )   ( resid   77 and name HB1  )   4.00  2.20  1.00
assign ( resid   66 and name HD1* )   ( resid   77 and name HB2  )   4.00  2.20  1.00
assign ( resid   35 and name HD1  )   ( resid   66 and name HD1* )   4.00  2.20  1.00
assign ( resid   36 and name HA   )   ( resid   37 and name HA   )   4.00  2.20  1.00
assign ( resid   37 and name HA   )   ( resid   38 and name HB2  )   4.00  2.20  1.00
assign ( resid   11 and name HG2* )   ( resid   37 and name HA   )   4.00  2.20  2.00
assign ( resid   37 and name HA   )   ( resid   65 and name HG2* )   4.00  2.20  2.00
assign ( resid   37 and name HA   )   ( resid   66 and name HD1* )   4.00  2.20  2.00
assign ( resid   18 and name HB*  )   ( resid   22 and name HA   )   4.00  2.20  1.00
assign ( resid   18 and name HB*  )   ( resid   22 and name HG1  )   4.00  2.20  1.00
assign ( resid   18 and name HB*  )   ( resid   22 and name HB*  )   4.00  2.20  1.00
assign ( resid   18 and name HB*  )   ( resid   22 and name HG2  )   4.00  2.20  1.00
assign ( resid   12 and name HB2  )   ( resid   14 and name HG1* )   4.00  2.20  1.00
assign ( resid   25 and name HG   )   ( resid   31 and name HZ3  )   4.00  2.20  2.00
assign ( resid   25 and name HG   )   ( resid   31 and name HH2  )   4.00  2.20  2.00
assign ( resid   12 and name HD*  )   ( resid   39 and name HA   )   4.00  2.20  1.00
assign ( resid   12 and name HD*  )   ( resid   39 and name HG2* )   4.00  2.20  2.00
assign ( resid   65 and name HA   )   ( resid   79 and name HD2  )   4.00  2.20  2.00
assign ( resid   65 and name HA   )   ( resid   85 and name HZ   )   4.00  2.20  2.00
assign ( resid   65 and name HA   )   ( resid   85 and name HE2  )   4.00  2.20  2.00
assign ( resid   65 and name HA   )   ( resid   66 and name HA   )   4.00  2.20  1.00
assign ( resid   65 and name HA   )   ( resid   78 and name HA   )   4.00  2.20  1.00
assign ( resid   65 and name HA   )   ( resid   78 and name HB1  )   4.00  2.20  2.00
assign ( resid   65 and name HA   )   ( resid   66 and name HG11 )   4.00  2.20  1.00
assign ( resid   65 and name HA   )   ( resid   66 and name HG2* )   4.00  2.20  1.00
assign ( resid   65 and name HG11 )   ( resid   85 and name HZ   )   4.00  2.20  2.00
assign ( resid   65 and name HG12 )   ( resid   85 and name HZ   )   4.00  2.20  2.00
assign ( resid    7 and name HB2  )   ( resid   65 and name HG12 )   4.00  2.20  1.00
assign ( resid   38 and name HN   )   ( resid   65 and name HG2* )   4.00  2.20  2.00
assign ( resid   65 and name HG2* )   ( resid   67 and name HN   )   4.00  2.20  2.00
assign ( resid   65 and name HG2* )   ( resid   85 and name HZ   )   3.00  1.20  0.50
assign ( resid   65 and name HG2* )   ( resid   66 and name HA   )   4.00  2.20  1.00
assign ( resid   65 and name HG2* )   ( resid   76 and name HA1  )   4.00  2.20  1.00
assign ( resid   65 and name HG2* )   ( resid   78 and name HB2  )   4.00  2.20  1.00
assign ( resid   65 and name HD1* )   ( resid   85 and name HZ   )   3.00  1.20  0.50
assign ( resid   65 and name HD1* )   ( resid   78 and name HA   )   4.00  2.20  1.00
assign ( resid    7 and name HB1  )   ( resid   65 and name HD1* )   3.00  1.20  0.50
assign ( resid    7 and name HB2  )   ( resid   65 and name HD1* )   3.00  1.20  0.50
assign ( resid   65 and name HD1* )   ( resid   78 and name HB2  )   4.00  2.20  1.00
assign ( resid   11 and name HA   )   ( resid   65 and name HD1* )   4.00  2.20  2.00
assign ( resid   64 and name HG*  )   ( resid   65 and name HD1* )   4.00  2.20  1.00
assign ( resid    8 and name HG1* )   ( resid   65 and name HD1* )   4.00  2.20  1.00
assign ( resid   88 and name HA   )   ( resid   91 and name HB2  )   4.00  2.20  1.00
assign ( resid   92 and name HA   )   ( resid   93 and name HD2  )   3.00  1.20  0.50
assign ( resid   92 and name HG2* )   ( resid   93 and name HD1  )   4.00  2.20  1.00
assign ( resid   53 and name HA   )   ( resid   53 and name HD2  )   4.00  2.20  1.00
assign ( resid   13 and name HA   )   ( resid   14 and name HG1* )   4.00  2.20  1.00
assign ( resid   53 and name HA   )   ( resid   56 and name HB2  )   4.00  2.20  1.00
assign ( resid   53 and name HA   )   ( resid   56 and name HG1  )   4.00  2.20  1.00
assign ( resid   12 and name HB2  )   ( resid   13 and name HA   )   4.00  2.20  2.00
assign ( resid   12 and name HG*  )   ( resid   13 and name HA   )   4.00  2.20  2.00
assign ( resid    2 and name HN   )   ( resid   85 and name HA   )   4.00  2.20  1.00
assign ( resid   85 and name HA   )   ( resid   85 and name HD2  )   4.00  2.20  1.00
assign ( resid    1 and name HB*  )   ( resid   85 and name HA   )   4.00  2.20  1.00
assign ( resid   84 and name HG*  )   ( resid   85 and name HA   )   4.00  2.20  1.00
assign ( resid    2 and name HN   )   ( resid   85 and name HB1  )   4.00  2.20  2.00
assign ( resid   85 and name HB1  )   ( resid   85 and name HE2  )   4.00  2.20  2.00
assign ( resid   85 and name HB2  )   ( resid   85 and name HE1  )   4.00  2.20  1.00
assign ( resid   43 and name HN   )   ( resid   44 and name HA1  )   4.00  2.20  2.00
assign ( resid   36 and name HA   )   ( resid   42 and name HN   )   4.00  2.20  1.00
assign ( resid   36 and name HA   )   ( resid   43 and name HA   )   4.00  2.20  1.00
assign ( resid   36 and name HA   )   ( resid   43 and name HG1* )   4.00  2.20  1.00
assign ( resid   36 and name HB   )   ( resid   69 and name HB2  )   4.00  2.20  1.00
assign ( resid   36 and name HG12 )   ( resid   43 and name HG2* )   4.00  2.20  2.00
assign ( resid   36 and name HG2* )   ( resid   92 and name HB   )   4.00  2.20  1.00
assign ( resid   14 and name HG2* )   ( resid   38 and name HD2  )   4.00  2.20  1.00
assign ( resid   36 and name HG2* )   ( resid   67 and name HB1  )   4.00  2.20  1.00
assign ( resid   36 and name HG2* )   ( resid   67 and name HB2  )   4.00  2.20  1.00
assign ( resid   36 and name HG2* )   ( resid   67 and name HG2  )   4.00  2.20  1.00
assign ( resid   15 and name HA   )   ( resid   36 and name HD1* )   4.00  2.20  1.00
assign ( resid   16 and name HA   )   ( resid   36 and name HD1* )   3.00  1.20  0.50
assign ( resid   36 and name HD1* )   ( resid   92 and name HB   )   4.00  2.20  1.00
assign ( resid   16 and name HD1  )   ( resid   36 and name HD1* )   4.00  2.20  1.00
assign ( resid   36 and name HD1* )   ( resid   41 and name HA2  )   4.00  2.20  1.00
assign ( resid   16 and name HD2  )   ( resid   36 and name HD1* )   4.00  2.20  1.00
assign ( resid   36 and name HD1* )   ( resid   69 and name HB2  )   4.00  2.20  1.00
assign ( resid   16 and name HG2  )   ( resid   36 and name HD1* )   4.00  2.20  1.00
assign ( resid   36 and name HD1* )   ( resid   43 and name HB   )   4.00  2.20  2.00
assign ( resid   16 and name HB1  )   ( resid   36 and name HD1* )   4.00  2.20  1.00
assign ( resid   16 and name HG1  )   ( resid   36 and name HD1* )   4.00  2.20  1.00
assign ( resid   16 and name HB2  )   ( resid   36 and name HD1* )   4.00  2.20  1.00
assign ( resid   75 and name HA   )   ( resid   84 and name HG*  )   4.00  2.20  1.00
assign ( resid   63 and name HB*  )   ( resid   64 and name HG*  )   4.00  2.20  1.00
assign ( resid   80 and name HA   )   ( resid   82 and name HN   )   4.00  2.20  1.00
assign ( resid   80 and name HN   )   ( resid   80 and name HB   )   4.00  2.20  1.00
assign ( resid   64 and name HA   )   ( resid   80 and name HG2* )   4.00  2.20  1.00
assign ( resid   64 and name HB1  )   ( resid   80 and name HG2* )   3.00  1.20  0.50
assign ( resid   64 and name HG*  )   ( resid   80 and name HG2* )   4.00  2.20  1.00
assign ( resid   64 and name HB2  )   ( resid   80 and name HG2* )   4.00  2.20  1.00
assign ( resid   80 and name HN   )   ( resid   80 and name HG1* )   4.00  2.20  1.00
assign ( resid   64 and name HA   )   ( resid   80 and name HG1* )   4.00  2.20  1.00
assign ( resid   11 and name HG2* )   ( resid   38 and name HB2  )   4.00  2.20  1.00
assign ( resid   38 and name HD1  )   ( resid   67 and name HN   )   4.00  2.20  2.00
assign ( resid   36 and name HG2* )   ( resid   38 and name HD2  )   4.00  2.20  1.00
assign ( resid   14 and name HG2* )   ( resid   38 and name HD1  )   4.00  2.20  1.00
assign ( resid   36 and name HG2* )   ( resid   38 and name HD1  )   4.00  2.20  2.00
assign ( resid   31 and name HA   )   ( resid   50 and name HD2  )   4.00  2.20  2.00
assign ( resid   31 and name HA   )   ( resid   45 and name HB2  )   4.00  2.20  1.00
assign ( resid   31 and name HA   )   ( resid   31 and name HE3  )   4.00  2.20  1.00
assign ( resid    5 and name HA   )   ( resid    6 and name HB*  )   4.00  2.20  1.00
assign ( resid   31 and name HD1  )   ( resid   33 and name HA   )   4.00  2.20  1.00
assign ( resid   78 and name HA   )   ( resid   80 and name HN   )   4.00  2.20  1.00
assign ( resid   78 and name HA   )   ( resid   79 and name HD2  )   4.00  2.20  2.00
assign ( resid   78 and name HA   )   ( resid   85 and name HE2  )   4.00  2.20  2.00
assign ( resid   65 and name HG12 )   ( resid   78 and name HA   )   4.00  2.20  1.00
assign ( resid   65 and name HG11 )   ( resid   78 and name HA   )   4.00  2.20  1.00
assign ( resid   65 and name HG2* )   ( resid   78 and name HA   )   4.00  2.20  1.00
assign ( resid   78 and name HA   )   ( resid   83 and name HG2* )   4.00  2.20  2.00
assign ( resid   78 and name HB1  )   ( resid   85 and name HE2  )   4.00  2.20  1.00
assign ( resid   78 and name HB2  )   ( resid   85 and name HE2  )   4.00  2.20  1.00
assign ( resid   78 and name HB1  )   ( resid   83 and name HG2* )   4.00  2.20  1.00
assign ( resid   65 and name HG11 )   ( resid   78 and name HB1  )   4.00  2.20  2.00
assign ( resid   65 and name HG12 )   ( resid   78 and name HB2  )   4.00  2.20  1.00
assign ( resid   65 and name HG12 )   ( resid   78 and name HB1  )   4.00  2.20  2.00
assign ( resid   44 and name HN   )   ( resid   54 and name HA   )   4.00  2.20  2.00
assign ( resid   54 and name HA   )   ( resid   57 and name HB1  )   4.00  2.20  1.00
assign ( resid   44 and name HA1  )   ( resid   54 and name HA   )   4.00  2.20  1.00
assign ( resid   54 and name HA   )   ( resid   57 and name HB2  )   4.00  2.20  1.00
assign ( resid   54 and name HB*  )   ( resid   79 and name HE2  )   4.00  2.20  1.00
assign ( resid   44 and name HA2  )   ( resid   54 and name HB*  )   4.00  2.20  2.00
assign ( resid   34 and name HA   )   ( resid   54 and name HB*  )   4.00  2.20  2.00
assign ( resid   35 and name HA   )   ( resid   54 and name HB*  )   4.00  2.20  2.00
assign ( resid   54 and name HB*  )   ( resid   55 and name HA   )   4.00  2.20  1.00
assign ( resid   35 and name HD1  )   ( resid   54 and name HB*  )   4.00  2.20  1.00
assign ( resid   44 and name HA1  )   ( resid   54 and name HB*  )   4.00  2.20  1.00
assign ( resid   35 and name HD2  )   ( resid   54 and name HB*  )   4.00  2.20  1.00
assign ( resid   35 and name HB*  )   ( resid   54 and name HB*  )   4.00  2.20  1.00
assign ( resid   54 and name HB*  )   ( resid   66 and name HD1* )   4.00  2.20  1.00
assign ( resid   32 and name HB   )   ( resid   48 and name HB*  )   4.00  2.20  1.00
assign ( resid   31 and name HA   )   ( resid   32 and name HG2* )   4.00  2.20  1.00
assign ( resid   32 and name HG2* )   ( resid   49 and name HA   )   3.00  1.20  0.50
assign ( resid   32 and name HG2* )   ( resid   50 and name HD1  )   4.00  2.20  1.00
assign ( resid   32 and name HG2* )   ( resid   50 and name HD2  )   4.00  2.20  1.00
assign ( resid   32 and name HG2* )   ( resid   48 and name HB*  )   4.00  2.20  1.00
assign ( resid   32 and name HG1* )   ( resid   48 and name HB*  )   4.00  2.20  1.00
assign ( resid   32 and name HG1* )   ( resid  102 and name HB   )   4.00  2.20  1.00
assign ( resid   47 and name HA   )   ( resid   52 and name HA   )   4.00  2.20  1.00
assign ( resid   72 and name HB2  )   ( resid   73 and name HA   )   4.00  2.20  1.00
assign ( resid   47 and name HA   )   ( resid   52 and name HB2  )   4.00  2.20  1.00
assign ( resid   47 and name HA   )   ( resid   52 and name HB1  )   4.00  2.20  1.00
assign ( resid   47 and name HA   )   ( resid   52 and name HD2  )   4.00  2.20  1.00
assign ( resid   47 and name HA   )   ( resid   52 and name HD1  )   4.00  2.20  1.00
assign ( resid   47 and name HA   )   ( resid   52 and name HG2  )   4.00  2.20  1.00
assign ( resid   87 and name HD1* )   ( resid   91 and name HA   )   4.00  2.20  2.00
assign ( resid   74 and name HA1  )   ( resid   91 and name HB2  )   4.00  2.20  1.00
assign ( resid   88 and name HA   )   ( resid   91 and name HB1  )   4.00  2.20  1.00
assign ( resid   74 and name HA2  )   ( resid   91 and name HB1  )   4.00  2.20  1.00
assign ( resid   32 and name HG1* )   ( resid  102 and name HG1* )   4.00  2.20  1.00
assign ( resid   32 and name HG1* )   ( resid  102 and name HG2* )   4.00  2.20  1.00
assign ( resid   98 and name HA   )   ( resid   99 and name HD1  )   3.00  1.20  0.50
assign ( resid   98 and name HA   )   ( resid   99 and name HD2  )   3.00  1.20  0.50
assign ( resid   19 and name HB1  )   ( resid   98 and name HA   )   4.00  2.20  1.00
assign ( resid   98 and name HA   )   ( resid   99 and name HG2  )   4.00  2.20  1.00
assign ( resid   31 and name HZ2  )   ( resid   98 and name HG2* )   3.00  1.20  0.50
assign ( resid   31 and name HH2  )   ( resid   98 and name HG2* )   4.00  2.20  1.00
assign ( resid   20 and name HA1  )   ( resid   98 and name HG2* )   4.00  2.20  1.00
assign ( resid   98 and name HG2* )   ( resid   99 and name HD1  )   4.00  2.20  1.00
assign ( resid   98 and name HG2* )   ( resid   99 and name HD2  )   4.00  2.20  1.00
assign ( resid   21 and name HN   )   ( resid   98 and name HG2* )   4.00  2.20  2.00
assign ( resid   20 and name HA2  )   ( resid   98 and name HG2* )   4.00  2.20  1.00
assign ( resid   19 and name HB1  )   ( resid   98 and name HG2* )   4.00  2.20  1.00
assign ( resid   19 and name HA   )   ( resid   98 and name HD1* )   4.00  2.20  1.00
assign ( resid   94 and name HB*  )   ( resid   98 and name HD1* )   4.00  2.20  2.00
assign ( resid   19 and name HB1  )   ( resid   98 and name HD1* )   4.00  2.20  1.00
assign ( resid   69 and name HA   )   ( resid   70 and name HA   )   4.00  2.20  1.00
assign ( resid   34 and name HB1  )   ( resid   70 and name HB2  )   4.00  2.20  2.00
assign ( resid   70 and name HB2  )   ( resid   98 and name HG2* )   4.00  2.20  2.00
assign ( resid   34 and name HD1* )   ( resid   70 and name HB2  )   4.00  2.20  1.00
assign ( resid   34 and name HB2  )   ( resid   98 and name HD1* )   4.00  2.20  1.00
assign ( resid   70 and name HB2  )   ( resid   98 and name HD1* )   4.00  2.20  2.00
assign ( resid   22 and name HA   )   ( resid   25 and name HD1* )   4.00  2.20  1.00
assign ( resid   63 and name HA   )   ( resid   64 and name HG*  )   4.00  2.20  1.00
assign ( resid   39 and name HG2* )   ( resid   63 and name HA   )   4.00  2.20  2.00
assign ( resid   40 and name HN   )   ( resid   63 and name HB*  )   4.00  2.20  2.00
assign ( resid   29 and name HA   )   ( resid   30 and name HD1  )   4.00  2.20  1.00
assign ( resid   27 and name HG11 )   ( resid   29 and name HB1  )   4.00  2.20  1.00
assign ( resid   27 and name HG11 )   ( resid   29 and name HB2  )   4.00  2.20  1.00
assign ( resid   27 and name HG12 )   ( resid   29 and name HB2  )   4.00  2.20  1.00
assign ( resid   27 and name HG12 )   ( resid   29 and name HB1  )   4.00  2.20  1.00
assign ( resid    5 and name HA   )   ( resid   83 and name HG2* )   4.00  2.20  1.00
assign ( resid    5 and name HA   )   ( resid    6 and name HA   )   4.00  2.20  1.00
assign ( resid   15 and name HA   )   ( resid   16 and name HD2  )   3.00  1.20  0.50
assign ( resid   15 and name HG2* )   ( resid   16 and name HD2  )   4.00  2.20  1.00
assign ( resid   16 and name HD1  )   ( resid   92 and name HB   )   4.00  2.20  2.00
assign ( resid   16 and name HD1  )   ( resid   92 and name HG2* )   4.00  2.20  1.00
assign ( resid   92 and name HG2* )   ( resid   93 and name HD2  )   4.00  2.20  1.00
assign ( resid   16 and name HD2  )   ( resid   92 and name HG2* )   4.00  2.20  1.00
assign ( resid   16 and name HG2  )   ( resid   92 and name HG2* )   4.00  2.20  1.00
assign ( resid   16 and name HG1  )   ( resid   92 and name HG2* )   3.00  1.20  0.50
assign ( resid   36 and name HD1* )   ( resid   92 and name HG2* )   3.00  1.20  0.50
assign ( resid   67 and name HA   )   ( resid   76 and name HA2  )   4.00  2.20  1.00
assign ( resid   67 and name HA   )   ( resid   76 and name HA1  )   4.00  2.20  1.00
assign ( resid   19 and name HD1* )   ( resid   96 and name HA1  )   4.00  2.20  1.00
assign ( resid   19 and name HD2* )   ( resid   96 and name HA1  )   4.00  2.20  1.00
assign ( resid   19 and name HD1* )   ( resid   96 and name HA2  )   4.00  2.20  1.00
assign ( resid   35 and name HA   )   ( resid   69 and name HB1  )   4.00  2.20  1.00
assign ( resid   20 and name HN   )   ( resid   34 and name HD2* )   4.00  2.20  2.00
assign ( resid   31 and name HZ2  )   ( resid   34 and name HD2* )   4.00  2.20  2.00
assign ( resid   20 and name HA1  )   ( resid   34 and name HD2* )   4.00  2.20  1.00
assign ( resid   21 and name HN   )   ( resid   34 and name HD2* )   4.00  2.20  1.00
assign ( resid   20 and name HA2  )   ( resid   34 and name HD2* )   4.00  2.20  1.00
assign ( resid   34 and name HD2* )   ( resid   43 and name HG1* )   4.00  2.20  1.00
assign ( resid   34 and name HD2* )   ( resid   70 and name HB2  )   4.00  2.20  1.00
assign ( resid    1 and name HB*  )   ( resid    2 and name HA   )   4.00  2.20  1.00
assign ( resid    1 and name HB*  )   ( resid    2 and name HB   )   4.00  2.20  2.00
assign ( resid   30 and name HA   )   ( resid   31 and name HN   )   3.00  1.20  0.50
assign ( resid   19 and name HD2* )   ( resid   20 and name HN   )   4.00  2.20  1.00
assign ( resid   50 and name HD2  )   ( resid   51 and name HN   )   4.00  2.20  2.00
assign ( resid   97 and name HB1  )   ( resid   98 and name HN   )   4.00  2.20  1.00
assign ( resid   97 and name HB2  )   ( resid   98 and name HN   )   4.00  2.20  1.00
assign ( resid   79 and name HB1  )   ( resid   80 and name HN   )   4.00  2.20  2.00
assign ( resid   11 and name HB   )   ( resid   12 and name HN   )   4.00  2.20  1.00
assign ( resid   11 and name HG2* )   ( resid   12 and name HN   )   4.00  2.20  1.00
assign ( resid   11 and name HD1* )   ( resid   12 and name HN   )   4.00  2.20  2.00
assign ( resid    2 and name HB   )   ( resid    3 and name HN   )   4.00  2.20  2.00
assign ( resid    2 and name HN   )   ( resid    2 and name HG2* )   4.00  2.20  2.00
assign ( resid    2 and name HG2* )   ( resid    3 and name HN   )   4.00  2.20  2.00
assign ( resid   83 and name HG1* )   ( resid   84 and name HN   )   4.00  2.20  1.00
assign ( resid   83 and name HG2* )   ( resid   84 and name HN   )   4.00  2.20  1.00
assign ( resid   66 and name HG12 )   ( resid   67 and name HN   )   4.00  2.20  2.00
assign ( resid   65 and name HG12 )   ( resid   66 and name HN   )   4.00  2.20  1.00
assign ( resid   85 and name HB1  )   ( resid   86 and name HN   )   4.00  2.20  1.00
assign ( resid   20 and name HA2  )   ( resid   31 and name HZ2  )   4.00  2.20  1.00
assign ( resid   77 and name HZ2  )   ( resid   82 and name HB2  )   4.00  2.20  2.00
assign ( resid   82 and name HB2  )   ( resid   83 and name HA   )   4.00  2.20  2.00
assign ( resid   82 and name HB1  )   ( resid   83 and name HA   )   4.00  2.20  1.00
assign ( resid   77 and name HZ2  )   ( resid   82 and name HG1  )   4.00  2.20  2.00
assign ( resid   82 and name HN   )   ( resid   82 and name HG1  )   4.00  2.20  1.00
assign ( resid   30 and name HB*  )   ( resid   31 and name HA   )   4.00  2.20  1.00
assign ( resid   30 and name HB*  )   ( resid  101 and name HB2  )   4.00  2.20  2.00
assign ( resid   29 and name HA   )   ( resid   30 and name HG2  )   4.00  2.20  1.00
assign ( resid   38 and name HB2  )   ( resid   65 and name HD1* )   4.00  2.20  2.00
assign ( resid   40 and name HN   )   ( resid   41 and name HA2  )   4.00  2.20  1.00
assign ( resid   25 and name HN   )   ( resid   25 and name HD2* )   4.00  2.20  1.00
assign ( resid   26 and name HN   )   ( resid   26 and name HD*  )   4.00  2.20  1.00
assign ( resid   39 and name HN   )   ( resid   39 and name HG2* )   4.00  2.20  1.00
assign ( resid   57 and name HA   )   ( resid   60 and name HN   )   4.00  2.20  1.00
assign ( resid   97 and name HA   )   ( resid   98 and name HN   )   3.00  1.20  0.50
assign ( resid   56 and name HA   )   ( resid   60 and name HN   )   4.00  2.20  1.00
assign ( resid   11 and name HN   )   ( resid   11 and name HB   )   4.00  2.20  1.00
assign ( resid   11 and name HG2* )   ( resid   85 and name HZ   )   4.00  2.20  1.00
assign ( resid   11 and name HN   )   ( resid   11 and name HD1* )   4.00  2.20  1.00
assign ( resid   11 and name HD1* )   ( resid   85 and name HE1  )   4.00  2.20  1.00
assign ( resid   11 and name HD1* )   ( resid   85 and name HZ   )   4.00  2.20  1.00
assign ( resid   24 and name HA   )   ( resid   29 and name HN   )   4.00  2.20  1.00
assign ( resid   14 and name HG2* )   ( resid   38 and name HE   )   4.00  2.20  1.00
assign ( resid   86 and name HN   )   ( resid   86 and name HB2  )   4.00  2.20  1.00
assign ( resid   22 and name HN   )   ( resid   43 and name HB   )   4.00  2.20  1.00
assign ( resid   20 and name HN   )   ( resid   43 and name HG1* )   4.00  2.20  2.00
assign ( resid   43 and name HN   )   ( resid   43 and name HG1* )   4.00  2.20  1.00
assign ( resid   22 and name HN   )   ( resid   43 and name HG1* )   4.00  2.20  1.00
assign ( resid   53 and name HA   )   ( resid   56 and name HN   )   4.00  2.20  1.00
assign ( resid   43 and name HN   )   ( resid   44 and name HA2  )   4.00  2.20  2.00
assign ( resid   17 and name HN   )   ( resid   36 and name HD1* )   4.00  2.20  1.00
assign ( resid  100 and name HN   )   ( resid  100 and name HG2  )   4.00  2.20  1.00
assign ( resid  100 and name HN   )   ( resid  100 and name HG1  )   4.00  2.20  1.00
assign ( resid   78 and name HA   )   ( resid   81 and name HN   )   4.00  2.20  1.00
assign ( resid   78 and name HB2  )   ( resid   81 and name HN   )   4.00  2.20  1.00
assign ( resid   65 and name HG11 )   ( resid   78 and name HB2  )   4.00  2.20  1.00
assign ( resid   91 and name HN   )   ( resid   91 and name HB2  )   4.00  2.20  1.00
assign ( resid   98 and name HN   )   ( resid   98 and name HB   )   4.00  2.20  1.00
assign ( resid   98 and name HN   )   ( resid   98 and name HG2* )   4.00  2.20  1.00
assign ( resid   29 and name HN   )   ( resid   29 and name HB1  )   4.00  2.20  1.00
assign ( resid   23 and name HA   )   ( resid   26 and name HD*  )   4.00  2.20  1.00
assign ( resid    6 and name HB*  )   ( resid    9 and name HB*  )   4.00  2.20  1.00
assign ( resid    7 and name HB1  )   ( resid   65 and name HG12 )   4.00  2.20  1.00
assign ( resid    8 and name HA   )   ( resid   65 and name HG12 )   4.00  2.20  2.00
assign ( resid    7 and name HA   )   ( resid    9 and name HB*  )   4.00  2.20  1.00
assign ( resid   11 and name HA   )   ( resid   12 and name HA   )   4.00  2.20  2.00
assign ( resid   11 and name HB   )   ( resid   38 and name HB2  )   3.00  1.20  0.50
assign ( resid   11 and name HD1* )   ( resid   87 and name HD2* )   4.00  2.20  1.00
assign ( resid   11 and name HD1* )   ( resid   12 and name HA   )   4.00  2.20  2.00
assign ( resid   11 and name HD1* )   ( resid   87 and name HA   )   4.00  2.20  2.00
assign ( resid   12 and name HA   )   ( resid   13 and name HA   )   4.00  2.20  1.00
assign ( resid   13 and name HA   )   ( resid   14 and name HA   )   4.00  2.20  1.00
assign ( resid   15 and name HG2* )   ( resid   16 and name HG2  )   4.00  2.20  2.00
assign ( resid   16 and name HA   )   ( resid   17 and name HA   )   4.00  2.20  1.00
assign ( resid   17 and name HA   )   ( resid   18 and name HA   )   4.00  2.20  2.00
assign ( resid   16 and name HA   )   ( resid   41 and name HA1  )   4.00  2.20  1.00
assign ( resid   16 and name HA   )   ( resid   41 and name HA2  )   4.00  2.20  1.00
assign ( resid   16 and name HA   )   ( resid   43 and name HG1* )   4.00  2.20  2.00
assign ( resid   16 and name HB1  )   ( resid   36 and name HG11 )   4.00  2.20  1.00
assign ( resid   15 and name HA   )   ( resid   16 and name HG2  )   4.00  2.20  1.00
assign ( resid   15 and name HA   )   ( resid   16 and name HG1  )   4.00  2.20  1.00
assign ( resid   15 and name HG2* )   ( resid   16 and name HG1  )   4.00  2.20  1.00
assign ( resid   18 and name HB*  )   ( resid   43 and name HG1* )   4.00  2.20  1.00
assign ( resid   18 and name HA   )   ( resid   19 and name HA   )   4.00  2.20  1.00
assign ( resid   20 and name HA2  )   ( resid   98 and name HD1* )   4.00  2.20  1.00
assign ( resid   21 and name HA   )   ( resid   22 and name HA   )   4.00  2.20  1.00
assign ( resid   31 and name HB2  )   ( resid   45 and name HA   )   4.00  2.20  1.00
assign ( resid   31 and name HH2  )   ( resid   99 and name HG2  )   4.00  2.20  1.00
assign ( resid   36 and name HG11 )   ( resid   43 and name HG2* )   4.00  2.20  1.00
assign ( resid   34 and name HA   )   ( resid   35 and name HA   )   4.00  2.20  1.00
assign ( resid   35 and name HA   )   ( resid   36 and name HG2* )   4.00  2.20  1.00
assign ( resid   34 and name HA   )   ( resid   35 and name HB*  )   4.00  2.20  2.00
assign ( resid   35 and name HB*  )   ( resid   66 and name HD1* )   4.00  2.20  1.00
assign ( resid   66 and name HG2* )   ( resid   66 and name HG11 )   4.00  2.20  1.00
assign ( resid   35 and name HB*  )   ( resid   68 and name HA2  )   4.00  2.20  1.00
assign ( resid   36 and name HB   )   ( resid   43 and name HG2* )   3.00  1.20  0.50
assign ( resid   16 and name HA   )   ( resid   36 and name HB   )   4.00  2.20  2.00
assign ( resid   16 and name HA   )   ( resid   36 and name HG12 )   4.00  2.20  2.00
assign ( resid   14 and name HG1* )   ( resid   38 and name HD2  )   4.00  2.20  2.00
assign ( resid   36 and name HG12 )   ( resid   38 and name HD2  )   4.00  2.20  2.00
assign ( resid   38 and name HA   )   ( resid   39 and name HA   )   4.00  2.20  1.00
assign ( resid   13 and name HA   )   ( resid   38 and name HA   )   4.00  2.20  2.00
assign ( resid   39 and name HB   )   ( resid   40 and name HB1  )   4.00  2.20  1.00
assign ( resid   36 and name HD1* )   ( resid   43 and name HG1* )   4.00  2.20  1.00
assign ( resid   44 and name HA2  )   ( resid   54 and name HA   )   4.00  2.20  2.00
assign ( resid   32 and name HG1* )   ( resid   49 and name HA   )   4.00  2.20  2.00
assign ( resid   32 and name HG1* )   ( resid   48 and name HA   )   4.00  2.20  2.00
assign ( resid   52 and name HG2  )   ( resid   55 and name HG2* )   4.00  2.20  1.00
assign ( resid   47 and name HA   )   ( resid   54 and name HB*  )   4.00  2.20  1.00
assign ( resid   52 and name HA   )   ( resid   54 and name HB*  )   4.00  2.20  1.00
assign ( resid   56 and name HB2  )   ( resid   57 and name HA   )   4.00  2.20  1.00
assign ( resid   64 and name HG*  )   ( resid   65 and name HG12 )   4.00  2.20  1.00
assign ( resid    8 and name HG2* )   ( resid   65 and name HD1* )   4.00  2.20  1.00
assign ( resid   11 and name HB   )   ( resid   65 and name HD1* )   4.00  2.20  2.00
assign ( resid   65 and name HA   )   ( resid   66 and name HG12 )   4.00  2.20  1.00
assign ( resid   38 and name HD1  )   ( resid   67 and name HB1  )   4.00  2.20  1.00
assign ( resid   38 and name HD1  )   ( resid   67 and name HB2  )   4.00  2.20  1.00
assign ( resid   36 and name HG2* )   ( resid   67 and name HG1  )   4.00  2.20  1.00
assign ( resid   36 and name HG2* )   ( resid   68 and name HA2  )   4.00  2.20  1.00
assign ( resid   43 and name HG2* )   ( resid   69 and name HB1  )   4.00  2.20  2.00
assign ( resid   82 and name HB1  )   ( resid   83 and name HG1* )   4.00  2.20  2.00
assign ( resid   43 and name HG1* )   ( resid   69 and name HB1  )   4.00  2.20  1.00
assign ( resid   71 and name HA   )   ( resid   72 and name HG*  )   4.00  2.20  2.00
assign ( resid   72 and name HA   )   ( resid   73 and name HA   )   4.00  2.20  1.00
assign ( resid   75 and name HB2  )   ( resid   86 and name HA   )   4.00  2.20  2.00
assign ( resid   68 and name HA1  )   ( resid   75 and name HZ2  )   4.00  2.20  2.00
assign ( resid   75 and name HA   )   ( resid   76 and name HA2  )   4.00  2.20  1.00
assign ( resid   76 and name HA2  )   ( resid   77 and name HA   )   4.00  2.20  1.00
assign ( resid   76 and name HA2  )   ( resid   87 and name HD2* )   4.00  2.20  2.00
assign ( resid   75 and name HA   )   ( resid   76 and name HA1  )   4.00  2.20  1.00
assign ( resid   77 and name HA   )   ( resid   84 and name HB*  )   4.00  2.20  1.00
assign ( resid   77 and name HB1  )   ( resid   84 and name HG*  )   4.00  2.20  1.00
assign ( resid   66 and name HG2* )   ( resid   77 and name HD1  )   4.00  2.20  1.00
assign ( resid   78 and name HB1  )   ( resid   81 and name HB2  )   4.00  2.20  1.00
assign ( resid   64 and name HA   )   ( resid   79 and name HB2  )   4.00  2.20  1.00
assign ( resid   79 and name HB2  )   ( resid   80 and name HG1* )   4.00  2.20  1.00
assign ( resid   66 and name HD1* )   ( resid   79 and name HD2  )   4.00  2.20  2.00
assign ( resid   78 and name HB1  )   ( resid   81 and name HB1  )   4.00  2.20  1.00
assign ( resid   82 and name HA   )   ( resid   83 and name HG2* )   4.00  2.20  2.00
assign ( resid   85 and name HA   )   ( resid   86 and name HA   )   4.00  2.20  1.00
assign ( resid   76 and name HA2  )   ( resid   85 and name HE1  )   4.00  2.20  2.00
assign ( resid   76 and name HA2  )   ( resid   85 and name HZ   )   4.00  2.20  2.00
assign ( resid   76 and name HA2  )   ( resid   85 and name HE2  )   4.00  2.20  2.00
assign ( resid   75 and name HA   )   ( resid   87 and name HB1  )   4.00  2.20  2.00
assign ( resid   75 and name HA   )   ( resid   87 and name HB2  )   4.00  2.20  2.00
assign ( resid   65 and name HG2* )   ( resid   76 and name HA2  )   4.00  2.20  1.00
assign ( resid   11 and name HD1* )   ( resid   38 and name HB2  )   4.00  2.20  1.00
assign ( resid   87 and name HD1* )   ( resid   90 and name HB1  )   4.00  2.20  2.00
assign ( resid   26 and name HA   )   ( resid   27 and name HA   )   4.00  2.20  1.00
assign ( resid   91 and name HA   )   ( resid   92 and name HA   )   4.00  2.20  2.00
assign ( resid   91 and name HG1  )   ( resid   92 and name HA   )   4.00  2.20  1.00
assign ( resid   16 and name HB1  )   ( resid   92 and name HG2* )   4.00  2.20  2.00
assign ( resid   98 and name HG2* )   ( resid   99 and name HA   )   4.00  2.20  1.00
assign ( resid   98 and name HA   )   ( resid   99 and name HA   )   4.00  2.20  1.00
assign ( resid   98 and name HG2* )   ( resid   99 and name HG2  )   4.00  2.20  1.00
assign ( resid   99 and name HA   )   ( resid  100 and name HA   )   4.00  2.20  1.00
assign ( resid   31 and name HE1  )   ( resid  101 and name HD2  )   4.00  2.20  1.00
assign ( resid   31 and name HE1  )   ( resid  101 and name HE2  )   4.00  2.20  1.00
assign ( resid   31 and name HE1  )   ( resid   34 and name HB2  )   4.00  2.20  2.00
assign ( resid   31 and name HE1  )   ( resid   34 and name HG   )   4.00  2.20  1.00
assign ( resid   31 and name HE1  )   ( resid   98 and name HG2* )   4.00  2.20  1.00
assign ( resid   31 and name HE1  )   ( resid   34 and name HD1* )   4.00  2.20  1.00
assign ( resid   31 and name HE1  )   ( resid   34 and name HD2* )   4.00  2.20  1.00
assign ( resid   77 and name HE1  )   ( resid   79 and name HD1  )   4.00  2.20  1.00
assign ( resid   77 and name HE1  )   ( resid   79 and name HE1  )   4.00  2.20  1.00
assign ( resid   77 and name HE1  )   ( resid   79 and name HA   )   3.00  1.20  0.50
assign ( resid   77 and name HE1  )   ( resid   82 and name HA   )   4.00  2.20  1.00
assign ( resid   77 and name HE1  )   ( resid   82 and name HG2  )   4.00  2.20  1.00
assign ( resid   77 and name HE1  )   ( resid   79 and name HB1  )   4.00  2.20  2.00
assign ( resid   66 and name HG12 )   ( resid   77 and name HE1  )   4.00  2.20  2.00
assign ( resid   66 and name HD1* )   ( resid   77 and name HE1  )   4.00  2.20  1.00
assign ( resid   36 and name HA   )   ( resid   37 and name HN   )   3.00  1.20  0.50
assign ( resid   37 and name HN   )   ( resid   42 and name HN   )   4.00  2.20  1.00
assign ( resid   37 and name HN   )   ( resid   41 and name HN   )   4.00  2.20  1.00
assign ( resid   37 and name HN   )   ( resid   42 and name HA   )   4.00  2.20  2.00
assign ( resid   37 and name HN   )   ( resid   37 and name HB1  )   4.00  2.20  1.00
assign ( resid   37 and name HN   )   ( resid   37 and name HB2  )   4.00  2.20  1.00
assign ( resid   37 and name HN   )   ( resid   66 and name HG2* )   4.00  2.20  1.00
assign ( resid   36 and name HG11 )   ( resid   37 and name HN   )   4.00  2.20  1.00
assign ( resid   36 and name HD1* )   ( resid   37 and name HN   )   4.00  2.20  1.00
assign ( resid   36 and name HG12 )   ( resid   37 and name HN   )   4.00  2.20  1.00
assign ( resid   36 and name HG2* )   ( resid   37 and name HN   )   4.00  2.20  1.00
assign ( resid   37 and name HN   )   ( resid   43 and name HG2* )   4.00  2.20  2.00
assign ( resid   20 and name HA2  )   ( resid   31 and name HE1  )   4.00  2.20  2.00
assign ( resid   31 and name HE1  )   ( resid   70 and name HB2  )   4.00  2.20  1.00
assign ( resid   68 and name HA1  )   ( resid   75 and name HE1  )   4.00  2.20  2.00
assign ( resid   73 and name HA   )   ( resid   75 and name HE1  )   4.00  2.20  2.00
assign ( resid   73 and name HB1  )   ( resid   75 and name HE1  )   4.00  2.20  1.00
assign ( resid   73 and name HB2  )   ( resid   75 and name HE1  )   4.00  2.20  1.00
assign ( resid   73 and name HN   )   ( resid   75 and name HE1  )   4.00  2.20  2.00
assign ( resid   92 and name HN   )   ( resid   92 and name HB   )   3.00  1.20  0.50
assign ( resid   91 and name HA   )   ( resid   92 and name HN   )   3.00  1.20  0.50
assign ( resid   91 and name HB2  )   ( resid   92 and name HN   )   4.00  2.20  1.00
assign ( resid   91 and name HB1  )   ( resid   92 and name HN   )   4.00  2.20  1.00
assign ( resid   91 and name HG1  )   ( resid   92 and name HN   )   4.00  2.20  1.00
assign ( resid   91 and name HG2  )   ( resid   92 and name HN   )   4.00  2.20  1.00
assign ( resid   92 and name HN   )   ( resid   92 and name HG2* )   4.00  2.20  1.00
assign ( resid   36 and name HG2* )   ( resid   92 and name HN   )   4.00  2.20  1.00
assign ( resid   53 and name HB1  )   ( resid   54 and name HN   )   4.00  2.20  1.00
assign ( resid   47 and name HA   )   ( resid   54 and name HN   )   4.00  2.20  2.00
assign ( resid   64 and name HA   )   ( resid   79 and name HN   )   4.00  2.20  1.00
assign ( resid   52 and name HA   )   ( resid   54 and name HN   )   4.00  2.20  1.00
assign ( resid   53 and name HB2  )   ( resid   54 and name HN   )   4.00  2.20  1.00
assign ( resid   44 and name HA1  )   ( resid   54 and name HN   )   4.00  2.20  1.00
assign ( resid   78 and name HA   )   ( resid   79 and name HN   )   3.00  1.20  0.50
assign ( resid   65 and name HA   )   ( resid   79 and name HN   )   4.00  2.20  1.00
assign ( resid   77 and name HD1  )   ( resid   79 and name HN   )   4.00  2.20  2.00
assign ( resid   79 and name HN   )   ( resid   79 and name HD2  )   4.00  2.20  1.00
assign ( resid   79 and name HN   )   ( resid   82 and name HN   )   4.00  2.20  1.00
assign ( resid   79 and name HN   )   ( resid   80 and name HN   )   3.00  1.20  0.50
assign ( resid   45 and name HN   )   ( resid   54 and name HN   )   4.00  2.20  1.00
assign ( resid   78 and name HB2  )   ( resid   79 and name HN   )   4.00  2.20  1.00
assign ( resid   78 and name HB1  )   ( resid   79 and name HN   )   4.00  2.20  1.00
assign ( resid   64 and name HB1  )   ( resid   79 and name HN   )   4.00  2.20  1.00
assign ( resid   64 and name HB2  )   ( resid   79 and name HN   )   4.00  2.20  1.00
assign ( resid   79 and name HN   )   ( resid   79 and name HB2  )   3.00  1.20  0.50
assign ( resid   54 and name HN   )   ( resid   55 and name HG2* )   4.00  2.20  1.00
assign ( resid   65 and name HG11 )   ( resid   79 and name HN   )   4.00  2.20  1.00
assign ( resid   79 and name HN   )   ( resid   80 and name HG2* )   4.00  2.20  1.00
assign ( resid   54 and name HN   )   ( resid   54 and name HB*  )   3.00  1.20  0.50
assign ( resid   52 and name HB1  )   ( resid   54 and name HN   )   4.00  2.20  1.00
assign ( resid   35 and name HN   )   ( resid   44 and name HN   )   4.00  2.20  1.00
assign ( resid   34 and name HN   )   ( resid   35 and name HN   )   4.00  2.20  1.00
assign ( resid   35 and name HN   )   ( resid   36 and name HN   )   4.00  2.20  1.00
assign ( resid   35 and name HN   )   ( resid   45 and name HA   )   4.00  2.20  1.00
assign ( resid   34 and name HA   )   ( resid   35 and name HN   )   3.00  1.20  0.50
assign ( resid   35 and name HN   )   ( resid   35 and name HD1  )   4.00  2.20  2.00
assign ( resid   35 and name HN   )   ( resid   44 and name HA1  )   4.00  2.20  2.00
assign ( resid   35 and name HN   )   ( resid   35 and name HD2  )   4.00  2.20  2.00
assign ( resid   35 and name HN   )   ( resid   69 and name HB2  )   4.00  2.20  2.00
assign ( resid   35 and name HN   )   ( resid   35 and name HB*  )   4.00  2.20  1.00
assign ( resid   35 and name HN   )   ( resid   54 and name HB*  )   4.00  2.20  1.00
assign ( resid   34 and name HB1  )   ( resid   35 and name HN   )   4.00  2.20  1.00
assign ( resid   35 and name HN   )   ( resid   43 and name HG1* )   4.00  2.20  1.00
assign ( resid   46 and name HB2  )   ( resid   48 and name HN   )   4.00  2.20  1.00
assign ( resid   46 and name HA   )   ( resid   48 and name HN   )   4.00  2.20  1.00
assign ( resid   47 and name HN   )   ( resid   48 and name HN   )   3.00  1.20  0.50
assign ( resid   48 and name HN   )   ( resid   49 and name HN   )   3.00  1.20  0.50
assign ( resid   47 and name HB1  )   ( resid   48 and name HN   )   4.00  2.20  1.00
assign ( resid   48 and name HN   )   ( resid   48 and name HB*  )   3.00  1.20  0.50
assign ( resid   46 and name HB1  )   ( resid   48 and name HN   )   4.00  2.20  1.00
assign ( resid   47 and name HB2  )   ( resid   48 and name HN   )   4.00  2.20  1.00
assign ( resid   32 and name HB   )   ( resid   48 and name HN   )   4.00  2.20  2.00
assign ( resid   48 and name HN   )   ( resid   54 and name HB*  )   4.00  2.20  2.00
assign ( resid   32 and name HG2* )   ( resid   48 and name HN   )   4.00  2.20  2.00
assign ( resid   55 and name HN   )   ( resid   56 and name HN   )   4.00  2.20  1.00
assign ( resid   47 and name HA   )   ( resid   55 and name HN   )   4.00  2.20  1.00
assign ( resid   55 and name HN   )   ( resid   55 and name HB   )   4.00  2.20  1.00
assign ( resid   55 and name HN   )   ( resid   55 and name HG2* )   4.00  2.20  1.00
assign ( resid   54 and name HB*  )   ( resid   55 and name HN   )   3.00  1.20  0.50
assign ( resid   52 and name HB1  )   ( resid   55 and name HN   )   4.00  2.20  1.00
assign ( resid   52 and name HB2  )   ( resid   55 and name HN   )   4.00  2.20  2.00
assign ( resid   55 and name HN   )   ( resid   56 and name HB2  )   4.00  2.20  2.00
assign ( resid   32 and name HG2* )   ( resid   33 and name HN   )   4.00  2.20  1.00
assign ( resid   32 and name HG1* )   ( resid   33 and name HN   )   4.00  2.20  1.00
assign ( resid   32 and name HB   )   ( resid   33 and name HN   )   3.00  1.20  0.50
assign ( resid   33 and name HN   )   ( resid   33 and name HB2  )   4.00  2.20  1.00
assign ( resid   33 and name HN   )   ( resid   33 and name HB1  )   4.00  2.20  1.00
assign ( resid   31 and name HD1  )   ( resid   33 and name HN   )   4.00  2.20  1.00
assign ( resid   38 and name HN   )   ( resid   38 and name HB2  )   3.00  1.20  0.50
assign ( resid   38 and name HN   )   ( resid   66 and name HG2* )   4.00  2.20  1.00
assign ( resid   11 and name HG2* )   ( resid   38 and name HN   )   4.00  2.20  1.00
assign ( resid   14 and name HG2* )   ( resid   38 and name HN   )   4.00  2.20  1.00
assign ( resid   14 and name HG1* )   ( resid   38 and name HN   )   4.00  2.20  1.00
assign ( resid   38 and name HN   )   ( resid   38 and name HB1  )   4.00  2.20  1.00
assign ( resid   38 and name HN   )   ( resid   38 and name HD2  )   4.00  2.20  1.00
assign ( resid   37 and name HB2  )   ( resid   38 and name HN   )   4.00  2.20  1.00
assign ( resid   37 and name HB1  )   ( resid   38 and name HN   )   4.00  2.20  1.00
assign ( resid   38 and name HN   )   ( resid   38 and name HD1  )   4.00  2.20  2.00
assign ( resid   37 and name HA   )   ( resid   38 and name HN   )   3.00  1.20  0.50
assign ( resid   38 and name HN   )   ( resid   66 and name HA   )   4.00  2.20  1.00
assign ( resid   38 and name HN   )   ( resid   40 and name HN   )   4.00  2.20  1.00
assign ( resid   38 and name HN   )   ( resid   38 and name HE   )   4.00  2.20  2.00
assign ( resid   38 and name HN   )   ( resid   39 and name HA   )   4.00  2.20  2.00
assign ( resid   12 and name HN   )   ( resid   38 and name HB1  )   4.00  2.20  1.00
assign ( resid   11 and name HA   )   ( resid   12 and name HN   )   3.00  1.20  0.50
assign ( resid   12 and name HN   )   ( resid   38 and name HA   )   4.00  2.20  1.00
assign ( resid   12 and name HN   )   ( resid   39 and name HA   )   4.00  2.20  1.00
assign ( resid   11 and name HN   )   ( resid   12 and name HN   )   4.00  2.20  1.00
assign ( resid   12 and name HN   )   ( resid   38 and name HE   )   4.00  2.20  1.00
assign ( resid   12 and name HN   )   ( resid   12 and name HD*  )   4.00  2.20  1.00
assign ( resid   12 and name HN   )   ( resid   12 and name HG*  )   3.00  1.20  0.50
assign ( resid   12 and name HN   )   ( resid   12 and name HB1  )   3.00  1.20  0.50
assign ( resid   11 and name HG11 )   ( resid   12 and name HN   )   4.00  2.20  1.00
assign ( resid   12 and name HN   )   ( resid   14 and name HG1* )   4.00  2.20  1.00
assign ( resid   12 and name HN   )   ( resid   38 and name HB2  )   4.00  2.20  1.00
assign ( resid   87 and name HN   )   ( resid   87 and name HB2  )   4.00  2.20  1.00
assign ( resid   87 and name HN   )   ( resid   87 and name HG   )   4.00  2.20  1.00
assign ( resid   87 and name HN   )   ( resid   87 and name HB1  )   4.00  2.20  1.00
assign ( resid   87 and name HN   )   ( resid   87 and name HD2* )   4.00  2.20  1.00
assign ( resid   87 and name HN   )   ( resid   87 and name HD1* )   4.00  2.20  1.00
assign ( resid   75 and name HA   )   ( resid   87 and name HN   )   3.00  1.20  0.50
assign ( resid   86 and name HA   )   ( resid   87 and name HN   )   3.00  1.20  0.50
assign ( resid   87 and name HN   )   ( resid   88 and name HA   )   4.00  2.20  1.00
assign ( resid   75 and name HB2  )   ( resid   87 and name HN   )   4.00  2.20  2.00
assign ( resid   75 and name HB1  )   ( resid   87 and name HN   )   4.00  2.20  1.00
assign ( resid   86 and name HB1  )   ( resid   87 and name HN   )   4.00  2.20  1.00
assign ( resid   86 and name HB2  )   ( resid   87 and name HN   )   4.00  2.20  1.00
assign ( resid   76 and name HN   )   ( resid   87 and name HN   )   4.00  2.20  1.00
assign ( resid   22 and name HN   )   ( resid   22 and name HG1  )   4.00  2.20  2.00
assign ( resid   22 and name HN   )   ( resid   22 and name HG2  )   4.00  2.20  2.00
assign ( resid   22 and name HN   )   ( resid   22 and name HB*  )   4.00  2.20  1.00
assign ( resid   18 and name HB*  )   ( resid   22 and name HN   )   4.00  2.20  1.00
assign ( resid   36 and name HN   )   ( resid   69 and name HN   )   4.00  2.20  1.00
assign ( resid   35 and name HA   )   ( resid   69 and name HN   )   3.00  1.20  0.50
assign ( resid   68 and name HA1  )   ( resid   69 and name HN   )   3.00  1.20  0.50
assign ( resid   69 and name HN   )   ( resid   69 and name HB2  )   3.00  1.20  0.50
assign ( resid   69 and name HN   )   ( resid   69 and name HB1  )   3.00  1.20  0.50
assign ( resid   68 and name HA2  )   ( resid   69 and name HN   )   3.00  1.20  0.50
assign ( resid   36 and name HG2* )   ( resid   69 and name HN   )   4.00  2.20  1.00
assign ( resid   43 and name HN   )   ( resid   43 and name HB   )   4.00  2.20  1.00
assign ( resid   42 and name HB2  )   ( resid   43 and name HN   )   4.00  2.20  1.00
assign ( resid   22 and name HB*  )   ( resid   43 and name HN   )   4.00  2.20  2.00
assign ( resid   43 and name HN   )   ( resid   43 and name HG2* )   4.00  2.20  1.00
assign ( resid   42 and name HA   )   ( resid   43 and name HN   )   3.00  1.20  0.50
assign ( resid   42 and name HN   )   ( resid   43 and name HN   )   4.00  2.20  1.00
assign ( resid   22 and name HN   )   ( resid   43 and name HN   )   4.00  2.20  2.00
assign ( resid   77 and name HN   )   ( resid   78 and name HN   )   4.00  2.20  1.00
assign ( resid   78 and name HN   )   ( resid   79 and name HN   )   4.00  2.20  1.00
assign ( resid   77 and name HE3  )   ( resid   78 and name HN   )   4.00  2.20  1.00
assign ( resid   78 and name HN   )   ( resid   85 and name HE2  )   4.00  2.20  2.00
assign ( resid   78 and name HN   )   ( resid   85 and name HD2  )   4.00  2.20  2.00
assign ( resid   78 and name HN   )   ( resid   82 and name HN   )   4.00  2.20  1.00
assign ( resid   78 and name HN   )   ( resid   83 and name HN   )   3.00  1.20  0.50
assign ( resid   77 and name HA   )   ( resid   78 and name HN   )   3.00  1.20  0.50
assign ( resid   77 and name HB2  )   ( resid   78 and name HN   )   4.00  2.20  1.00
assign ( resid   78 and name HN   )   ( resid   78 and name HB1  )   3.00  1.20  0.50
assign ( resid   78 and name HN   )   ( resid   78 and name HB2  )   3.00  1.20  0.50
assign ( resid   78 and name HN   )   ( resid   83 and name HG2* )   4.00  2.20  1.00
assign ( resid   65 and name HG2* )   ( resid   78 and name HN   )   4.00  2.20  1.00
assign ( resid   66 and name HG11 )   ( resid   78 and name HN   )   4.00  2.20  2.00
assign ( resid   78 and name HN   )   ( resid   83 and name HB   )   4.00  2.20  2.00
assign ( resid   65 and name HG12 )   ( resid   78 and name HN   )   4.00  2.20  1.00
assign ( resid   72 and name HA   )   ( resid   73 and name HN   )   3.00  1.20  0.50
assign ( resid   73 and name HN   )   ( resid   74 and name HN   )   3.00  1.20  0.50
assign ( resid   72 and name HD*  )   ( resid   73 and name HN   )   4.00  2.20  1.00
assign ( resid   73 and name HN   )   ( resid   74 and name HA2  )   4.00  2.20  2.00
assign ( resid   73 and name HN   )   ( resid   73 and name HB1  )   4.00  2.20  1.00
assign ( resid   73 and name HN   )   ( resid   73 and name HG2  )   4.00  2.20  1.00
assign ( resid   73 and name HN   )   ( resid   73 and name HG1  )   4.00  2.20  1.00
assign ( resid   73 and name HN   )   ( resid   91 and name HE*  )   4.00  2.20  1.00
assign ( resid   73 and name HN   )   ( resid   73 and name HB2  )   4.00  2.20  1.00
assign ( resid   73 and name HN   )   ( resid   75 and name HN   )   4.00  2.20  2.00
assign ( resid   57 and name HN   )   ( resid   58 and name HN   )   3.00  1.20  0.50
assign ( resid   58 and name HN   )   ( resid   59 and name HN   )   3.00  1.20  0.50
assign ( resid   58 and name HN   )   ( resid   58 and name HD1  )   4.00  2.20  2.00
assign ( resid   58 and name HN   )   ( resid   58 and name HD2  )   4.00  2.20  2.00
assign ( resid   58 and name HN   )   ( resid   79 and name HE2  )   4.00  2.20  2.00
assign ( resid   54 and name HA   )   ( resid   58 and name HN   )   4.00  2.20  1.00
assign ( resid   58 and name HN   )   ( resid   58 and name HB2  )   3.00  1.20  0.50
assign ( resid   58 and name HN   )   ( resid   58 and name HB1  )   3.00  1.20  0.50
assign ( resid   58 and name HN   )   ( resid   60 and name HB*  )   4.00  2.20  1.00
assign ( resid    2 and name HG2* )   ( resid   84 and name HN   )   4.00  2.20  1.00
assign ( resid   84 and name HN   )   ( resid   84 and name HB*  )   3.00  1.20  0.50
assign ( resid   83 and name HB   )   ( resid   84 and name HN   )   3.00  1.20  0.50
assign ( resid   84 and name HN   )   ( resid   84 and name HG*  )   4.00  2.20  1.00
assign ( resid   83 and name HA   )   ( resid   84 and name HN   )   3.00  1.20  0.50
assign ( resid   77 and name HE3  )   ( resid   84 and name HN   )   4.00  2.20  1.00
assign ( resid   77 and name HZ3  )   ( resid   84 and name HN   )   4.00  2.20  1.00
assign ( resid   22 and name HN   )   ( resid   24 and name HN   )   4.00  2.20  2.00
assign ( resid   24 and name HN   )   ( resid   31 and name HE3  )   4.00  2.20  2.00
assign ( resid   24 and name HN   )   ( resid   51 and name HE1  )   4.00  2.20  1.00
assign ( resid   24 and name HN   )   ( resid   25 and name HN   )   3.00  1.20  0.50
assign ( resid   24 and name HN   )   ( resid   24 and name HB1  )   4.00  2.20  1.00
assign ( resid   24 and name HN   )   ( resid   24 and name HB2  )   4.00  2.20  1.00
assign ( resid   21 and name HB1  )   ( resid   24 and name HN   )   4.00  2.20  1.00
assign ( resid   23 and name HG*  )   ( resid   24 and name HN   )   4.00  2.20  1.00
assign ( resid   21 and name HB2  )   ( resid   24 and name HN   )   4.00  2.20  1.00
assign ( resid   23 and name HB1  )   ( resid   24 and name HN   )   4.00  2.20  1.00
assign ( resid   23 and name HB2  )   ( resid   24 and name HN   )   4.00  2.20  1.00
assign ( resid   19 and name HN   )   ( resid   20 and name HN   )   4.00  2.20  1.00
assign ( resid   18 and name HA   )   ( resid   19 and name HN   )   3.00  1.20  0.50
assign ( resid   19 and name HN   )   ( resid   19 and name HB1  )   4.00  2.20  1.00
assign ( resid   19 and name HN   )   ( resid   19 and name HB2  )   3.00  1.20  0.50
assign ( resid   19 and name HN   )   ( resid   19 and name HG   )   4.00  2.20  1.00
assign ( resid   18 and name HB*  )   ( resid   19 and name HN   )   3.00  1.20  0.50
assign ( resid   19 and name HN   )   ( resid   19 and name HD1* )   4.00  2.20  1.00
assign ( resid   19 and name HN   )   ( resid   19 and name HD2* )   4.00  2.20  1.00
assign ( resid   21 and name HN   )   ( resid   21 and name HB2  )   4.00  2.20  1.00
assign ( resid   21 and name HN   )   ( resid   22 and name HN   )   4.00  2.20  2.00
assign ( resid   21 and name HN   )   ( resid   31 and name HE3  )   4.00  2.20  2.00
assign ( resid   21 and name HN   )   ( resid   31 and name HZ3  )   4.00  2.20  2.00
assign ( resid   21 and name HN   )   ( resid   31 and name HZ2  )   4.00  2.20  1.00
assign ( resid   21 and name HN   )   ( resid   21 and name HB1  )   4.00  2.20  1.00
assign ( resid   21 and name HN   )   ( resid   43 and name HG1* )   4.00  2.20  1.00
assign ( resid   21 and name HN   )   ( resid   25 and name HD2* )   4.00  2.20  1.00
assign ( resid   21 and name HN   )   ( resid   34 and name HD1* )   4.00  2.20  1.00
assign ( resid   21 and name HN   )   ( resid   25 and name HD1* )   4.00  2.20  1.00
assign ( resid    7 and name HA   )   ( resid    9 and name HN   )   4.00  2.20  1.00
assign ( resid    8 and name HB   )   ( resid    9 and name HN   )   4.00  2.20  1.00
assign ( resid    9 and name HN   )   ( resid    9 and name HB*  )   3.00  1.20  0.50
assign ( resid    8 and name HG2* )   ( resid    9 and name HN   )   4.00  2.20  1.00
assign ( resid    8 and name HG1* )   ( resid    9 and name HN   )   4.00  2.20  1.00
assign ( resid    7 and name HN   )   ( resid    8 and name HN   )   3.00  1.20  0.50
assign ( resid    8 and name HN   )   ( resid    9 and name HN   )   3.00  1.20  0.50
assign ( resid    5 and name HN   )   ( resid    8 and name HN   )   4.00  2.20  1.00
assign ( resid    5 and name HA   )   ( resid    8 and name HN   )   4.00  2.20  2.00
assign ( resid    6 and name HA   )   ( resid    8 and name HN   )   4.00  2.20  1.00
assign ( resid    8 and name HN   )   ( resid    8 and name HB   )   3.00  1.20  0.50
assign ( resid    6 and name HB*  )   ( resid    8 and name HN   )   4.00  2.20  2.00
assign ( resid    8 and name HN   )   ( resid   65 and name HG12 )   4.00  2.20  2.00
assign ( resid    8 and name HN   )   ( resid    9 and name HB*  )   4.00  2.20  1.00
assign ( resid    8 and name HN   )   ( resid   11 and name HD1* )   4.00  2.20  2.00
assign ( resid    8 and name HN   )   ( resid   65 and name HD1* )   4.00  2.20  1.00
assign ( resid    8 and name HN   )   ( resid    8 and name HG2* )   4.00  2.20  1.00
assign ( resid    8 and name HN   )   ( resid    8 and name HG1* )   4.00  2.20  1.00
assign ( resid    8 and name HN   )   ( resid   11 and name HG12 )   4.00  2.20  2.00
assign ( resid   32 and name HN   )   ( resid   49 and name HN   )   4.00  2.20  2.00
assign ( resid   46 and name HN   )   ( resid   49 and name HN   )   4.00  2.20  1.00
assign ( resid   47 and name HN   )   ( resid   49 and name HN   )   4.00  2.20  2.00
assign ( resid   49 and name HN   )   ( resid   52 and name HN   )   4.00  2.20  1.00
assign ( resid   49 and name HN   )   ( resid   49 and name HB1  )   4.00  2.20  1.00
assign ( resid   49 and name HN   )   ( resid   49 and name HB2  )   4.00  2.20  1.00
assign ( resid   49 and name HN   )   ( resid   52 and name HA   )   4.00  2.20  1.00
assign ( resid   49 and name HN   )   ( resid   50 and name HD1  )   4.00  2.20  2.00
assign ( resid   49 and name HN   )   ( resid   50 and name HD2  )   4.00  2.20  1.00
assign ( resid   48 and name HB*  )   ( resid   49 and name HN   )   4.00  2.20  1.00
assign ( resid   32 and name HB   )   ( resid   49 and name HN   )   4.00  2.20  1.00
assign ( resid   49 and name HN   )   ( resid   52 and name HG1  )   4.00  2.20  2.00
assign ( resid   32 and name HG2* )   ( resid   49 and name HN   )   4.00  2.20  1.00
assign ( resid   49 and name HN   )   ( resid   52 and name HG2  )   4.00  2.20  1.00
assign ( resid   33 and name HN   )   ( resid   49 and name HN   )   4.00  2.20  2.00
assign ( resid   61 and name HN   )   ( resid   63 and name HN   )   4.00  2.20  1.00
assign ( resid   63 and name HN   )   ( resid   63 and name HD2  )   4.00  2.20  1.00
assign ( resid   63 and name HN   )   ( resid   64 and name HD1  )   4.00  2.20  1.00
assign ( resid   63 and name HN   )   ( resid   64 and name HD2  )   4.00  2.20  1.00
assign ( resid   63 and name HN   )   ( resid   63 and name HB*  )   3.00  1.20  0.50
assign ( resid   58 and name HA   )   ( resid   63 and name HN   )   4.00  2.20  1.00
assign ( resid   61 and name HB   )   ( resid   63 and name HN   )   4.00  2.20  1.00
assign ( resid   42 and name HN   )   ( resid   63 and name HE1  )   4.00  2.20  2.00
assign ( resid   40 and name HN   )   ( resid   42 and name HN   )   4.00  2.20  1.00
assign ( resid   42 and name HN   )   ( resid   42 and name HB1  )   4.00  2.20  1.00
assign ( resid   42 and name HN   )   ( resid   42 and name HB2  )   4.00  2.20  1.00
assign ( resid   45 and name HN   )   ( resid   46 and name HN   )   4.00  2.20  1.00
assign ( resid   45 and name HN   )   ( resid   53 and name HN   )   4.00  2.20  1.00
assign ( resid   44 and name HA2  )   ( resid   45 and name HN   )   3.00  1.20  0.50
assign ( resid   45 and name HN   )   ( resid   45 and name HB1  )   4.00  2.20  1.00
assign ( resid   45 and name HN   )   ( resid   53 and name HB1  )   4.00  2.20  1.00
assign ( resid   45 and name HN   )   ( resid   53 and name HB2  )   4.00  2.20  1.00
assign ( resid   45 and name HN   )   ( resid   53 and name HA   )   4.00  2.20  2.00
assign ( resid   44 and name HA1  )   ( resid   45 and name HN   )   3.00  1.20  0.50
assign ( resid   45 and name HN   )   ( resid   45 and name HB2  )   4.00  2.20  1.00
assign ( resid   45 and name HN   )   ( resid   54 and name HB*  )   4.00  2.20  1.00
assign ( resid  101 and name HN   )   ( resid  101 and name HB2  )   4.00  2.20  1.00
assign ( resid  101 and name HN   )   ( resid  101 and name HB1  )   4.00  2.20  1.00
assign ( resid  100 and name HD*  )   ( resid  101 and name HN   )   4.00  2.20  1.00
assign ( resid  100 and name HA   )   ( resid  101 and name HN   )   3.00  1.20  0.50
assign ( resid  101 and name HN   )   ( resid  102 and name HA   )   4.00  2.20  1.00
assign ( resid  101 and name HN   )   ( resid  101 and name HD2  )   4.00  2.20  1.00
assign ( resid  101 and name HN   )   ( resid  102 and name HG1* )   4.00  2.20  2.00
assign ( resid  101 and name HN   )   ( resid  102 and name HG2* )   4.00  2.20  2.00
assign ( resid   32 and name HN   )   ( resid   33 and name HN   )   4.00  2.20  1.00
assign ( resid   31 and name HD1  )   ( resid   32 and name HN   )   4.00  2.20  1.00
assign ( resid   31 and name HA   )   ( resid   32 and name HN   )   4.00  2.20  1.00
assign ( resid   32 and name HN   )   ( resid   49 and name HA   )   4.00  2.20  1.00
assign ( resid   32 and name HN   )   ( resid   45 and name HB1  )   4.00  2.20  2.00
assign ( resid   31 and name HB1  )   ( resid   32 and name HN   )   4.00  2.20  1.00
assign ( resid   31 and name HB2  )   ( resid   32 and name HN   )   4.00  2.20  1.00
assign ( resid   32 and name HN   )   ( resid   45 and name HB2  )   4.00  2.20  2.00
assign ( resid   32 and name HN   )   ( resid   32 and name HB   )   4.00  2.20  1.00
assign ( resid   32 and name HN   )   ( resid   32 and name HG2* )   4.00  2.20  1.00
assign ( resid   32 and name HN   )   ( resid   32 and name HG1* )   4.00  2.20  1.00
assign ( resid    5 and name HA   )   ( resid    7 and name HN   )   4.00  2.20  1.00
assign ( resid    7 and name HN   )   ( resid    9 and name HN   )   4.00  2.20  1.00
assign ( resid    7 and name HN   )   ( resid    7 and name HB1  )   4.00  2.20  1.00
assign ( resid    5 and name HB1  )   ( resid    7 and name HN   )   4.00  2.20  1.00
assign ( resid    7 and name HN   )   ( resid    7 and name HB2  )   4.00  2.20  1.00
assign ( resid    5 and name HB2  )   ( resid    7 and name HN   )   4.00  2.20  1.00
assign ( resid    7 and name HN   )   ( resid    8 and name HB   )   4.00  2.20  2.00
assign ( resid    6 and name HB*  )   ( resid    7 and name HN   )   4.00  2.20  1.00
assign ( resid    6 and name HG1  )   ( resid    7 and name HN   )   4.00  2.20  1.00
assign ( resid    7 and name HN   )   ( resid   65 and name HD1* )   4.00  2.20  1.00
assign ( resid    6 and name HG2  )   ( resid    7 and name HN   )   4.00  2.20  1.00
assign ( resid   79 and name HN   )   ( resid   81 and name HN   )   4.00  2.20  1.00
assign ( resid   81 and name HN   )   ( resid   83 and name HN   )   4.00  2.20  1.00
assign ( resid   78 and name HB1  )   ( resid   81 and name HN   )   4.00  2.20  1.00
assign ( resid   81 and name HN   )   ( resid   82 and name HA   )   4.00  2.20  1.00
assign ( resid   80 and name HB   )   ( resid   81 and name HN   )   4.00  2.20  1.00
assign ( resid   80 and name HG2* )   ( resid   81 and name HN   )   3.00  1.20  0.50
assign ( resid   81 and name HN   )   ( resid   83 and name HG2* )   4.00  2.20  1.00
assign ( resid   81 and name HN   )   ( resid   82 and name HB2  )   4.00  2.20  2.00
assign ( resid   81 and name HN   )   ( resid   82 and name HG2  )   4.00  2.20  2.00
assign ( resid   81 and name HN   )   ( resid   82 and name HG1  )   4.00  2.20  1.00
assign ( resid   77 and name HN   )   ( resid   77 and name HB2  )   4.00  2.20  1.00
assign ( resid   66 and name HN   )   ( resid   77 and name HN   )   4.00  2.20  1.00
assign ( resid   76 and name HN   )   ( resid   77 and name HN   )   4.00  2.20  1.00
assign ( resid   75 and name HZ3  )   ( resid   77 and name HN   )   4.00  2.20  1.00
assign ( resid   65 and name HA   )   ( resid   77 and name HN   )   4.00  2.20  1.00
assign ( resid   76 and name HA2  )   ( resid   77 and name HN   )   3.00  1.20  0.50
assign ( resid   67 and name HA   )   ( resid   77 and name HN   )   4.00  2.20  1.00
assign ( resid   76 and name HA1  )   ( resid   77 and name HN   )   4.00  2.20  1.00
assign ( resid   77 and name HN   )   ( resid   77 and name HB1  )   4.00  2.20  1.00
assign ( resid   66 and name HG11 )   ( resid   77 and name HN   )   4.00  2.20  1.00
assign ( resid   66 and name HG12 )   ( resid   77 and name HN   )   4.00  2.20  1.00
assign ( resid   65 and name HG2* )   ( resid   77 and name HN   )   3.00  1.20  0.50
assign ( resid   65 and name HG12 )   ( resid   77 and name HN   )   4.00  2.20  2.00
assign ( resid   66 and name HB   )   ( resid   77 and name HN   )   4.00  2.20  2.00
assign ( resid   75 and name HE3  )   ( resid   77 and name HN   )   4.00  2.20  1.00
assign ( resid   85 and name HD1  )   ( resid   86 and name HN   )   4.00  2.20  1.00
assign ( resid    2 and name HN   )   ( resid   86 and name HN   )   4.00  2.20  2.00
assign ( resid   85 and name HN   )   ( resid   86 and name HN   )   4.00  2.20  2.00
assign ( resid   86 and name HN   )   ( resid   87 and name HN   )   4.00  2.20  2.00
assign ( resid   85 and name HA   )   ( resid   86 and name HN   )   3.00  1.20  0.50
assign ( resid   85 and name HB2  )   ( resid   86 and name HN   )   3.00  1.20  0.50
assign ( resid   86 and name HN   )   ( resid   86 and name HB1  )   4.00  2.20  1.00
assign ( resid    1 and name HB*  )   ( resid   86 and name HN   )   4.00  2.20  1.00
assign ( resid   35 and name HA   )   ( resid   36 and name HN   )   3.00  1.20  0.50
assign ( resid   36 and name HN   )   ( resid   69 and name HB2  )   4.00  2.20  1.00
assign ( resid   36 and name HN   )   ( resid   68 and name HA2  )   4.00  2.20  1.00
assign ( resid   35 and name HB*  )   ( resid   36 and name HN   )   4.00  2.20  1.00
assign ( resid   36 and name HN   )   ( resid   36 and name HG2* )   3.00  1.20  0.50
assign ( resid   36 and name HN   )   ( resid   36 and name HB   )   4.00  2.20  1.00
assign ( resid   36 and name HN   )   ( resid   66 and name HG2* )   4.00  2.20  2.00
assign ( resid   36 and name HN   )   ( resid   66 and name HD1* )   4.00  2.20  1.00
assign ( resid   13 and name HA   )   ( resid   14 and name HN   )   2.00  0.20  0.70
assign ( resid   13 and name HB   )   ( resid   14 and name HN   )   4.00  2.20  1.00
assign ( resid   13 and name HG2* )   ( resid   14 and name HN   )   3.00  1.20  0.50
assign ( resid   14 and name HN   )   ( resid   14 and name HG2* )   3.00  1.20  0.50
assign ( resid   14 and name HN   )   ( resid   14 and name HG1* )   4.00  2.20  1.00
assign ( resid   14 and name HN   )   ( resid   36 and name HD1* )   4.00  2.20  2.00
assign ( resid   14 and name HN   )   ( resid   38 and name HE   )   4.00  2.20  1.00
assign ( resid   93 and name HA   )   ( resid   94 and name HN   )   3.00  1.20  0.50
assign ( resid   94 and name HN   )   ( resid   94 and name HB*  )   3.00  1.20  0.50
assign ( resid   93 and name HB1  )   ( resid   94 and name HN   )   4.00  2.20  1.00
assign ( resid   93 and name HB2  )   ( resid   94 and name HN   )   4.00  2.20  1.00
assign ( resid   66 and name HN   )   ( resid   85 and name HZ   )   4.00  2.20  2.00
assign ( resid   66 and name HN   )   ( resid   85 and name HE2  )   4.00  2.20  2.00
assign ( resid   65 and name HA   )   ( resid   66 and name HN   )   3.00  1.20  0.50
assign ( resid   66 and name HN   )   ( resid   78 and name HA   )   4.00  2.20  1.00
assign ( resid   66 and name HN   )   ( resid   77 and name HD1  )   4.00  2.20  1.00
assign ( resid   66 and name HN   )   ( resid   77 and name HB2  )   4.00  2.20  2.00
assign ( resid   66 and name HN   )   ( resid   77 and name HB1  )   4.00  2.20  1.00
assign ( resid   66 and name HN   )   ( resid   66 and name HG11 )   3.00  1.20  0.50
assign ( resid   66 and name HN   )   ( resid   66 and name HB   )   4.00  2.20  1.00
assign ( resid   66 and name HN   )   ( resid   66 and name HG12 )   3.00  1.20  0.50
assign ( resid   65 and name HG2* )   ( resid   66 and name HN   )   3.00  1.20  0.50
assign ( resid   65 and name HB   )   ( resid   66 and name HN   )   4.00  2.20  1.00
assign ( resid   89 and name HN   )   ( resid   90 and name HN   )   3.00  1.20  0.50
assign ( resid   88 and name HB2  )   ( resid   89 and name HN   )   4.00  2.20  1.00
assign ( resid   88 and name HB1  )   ( resid   89 and name HN   )   4.00  2.20  1.00
assign ( resid   89 and name HN   )   ( resid   89 and name HB1  )   4.00  2.20  1.00
assign ( resid   89 and name HN   )   ( resid   89 and name HB2  )   4.00  2.20  1.00
assign ( resid   89 and name HN   )   ( resid   90 and name HB2  )   4.00  2.20  2.00
assign ( resid   89 and name HN   )   ( resid   90 and name HG2  )   4.00  2.20  2.00
assign ( resid   89 and name HN   )   ( resid   90 and name HG1  )   4.00  2.20  1.00
assign ( resid   12 and name HB2  )   ( resid   13 and name HN   )   4.00  2.20  1.00
assign ( resid   12 and name HB1  )   ( resid   13 and name HN   )   4.00  2.20  1.00
assign ( resid   13 and name HN   )   ( resid   13 and name HG2* )   4.00  2.20  2.00
assign ( resid   36 and name HG2* )   ( resid   67 and name HN   )   4.00  2.20  1.00
assign ( resid   66 and name HB   )   ( resid   67 and name HN   )   3.00  1.20  0.50
assign ( resid   66 and name HD1* )   ( resid   67 and name HN   )   4.00  2.20  1.00
assign ( resid   38 and name HD2  )   ( resid   67 and name HN   )   4.00  2.20  2.00
assign ( resid   37 and name HA   )   ( resid   67 and name HN   )   4.00  2.20  1.00
assign ( resid   66 and name HA   )   ( resid   67 and name HN   )   3.00  1.20  0.50
assign ( resid   36 and name HN   )   ( resid   67 and name HN   )   3.00  1.20  0.50
assign ( resid   84 and name HA   )   ( resid   85 and name HN   )   3.00  1.20  0.50
assign ( resid   85 and name HN   )   ( resid   85 and name HD2  )   4.00  2.20  1.00
assign ( resid   85 and name HN   )   ( resid   85 and name HE2  )   4.00  2.20  1.00
assign ( resid   75 and name HB2  )   ( resid   85 and name HN   )   4.00  2.20  1.00
assign ( resid   85 and name HN   )   ( resid   85 and name HB2  )   4.00  2.20  1.00
assign ( resid   85 and name HN   )   ( resid   85 and name HB1  )   4.00  2.20  1.00
assign ( resid   76 and name HA1  )   ( resid   85 and name HN   )   4.00  2.20  1.00
assign ( resid   84 and name HG*  )   ( resid   85 and name HN   )   3.00  1.20  0.50
assign ( resid   84 and name HB*  )   ( resid   85 and name HN   )   4.00  2.20  1.00
assign ( resid   83 and name HG2* )   ( resid   85 and name HN   )   4.00  2.20  2.00
assign ( resid   17 and name HN   )   ( resid   43 and name HG2* )   3.00  1.20  0.50
assign ( resid   15 and name HG2* )   ( resid   17 and name HN   )   4.00  2.20  2.00
assign ( resid   17 and name HN   )   ( resid   18 and name HB*  )   4.00  2.20  2.00
assign ( resid   16 and name HB2  )   ( resid   17 and name HN   )   4.00  2.20  1.00
assign ( resid   16 and name HB1  )   ( resid   17 and name HN   )   4.00  2.20  1.00
assign ( resid   17 and name HN   )   ( resid   41 and name HA2  )   4.00  2.20  2.00
assign ( resid   17 and name HN   )   ( resid   17 and name HB1  )   4.00  2.20  1.00
assign ( resid   17 and name HN   )   ( resid   17 and name HB2  )   4.00  2.20  1.00
assign ( resid   16 and name HA   )   ( resid   17 and name HN   )   3.00  1.20  0.50
assign ( resid   17 and name HN   )   ( resid   43 and name HN   )   4.00  2.20  1.00
assign ( resid   90 and name HN   )   ( resid   90 and name HB1  )   4.00  2.20  1.00
assign ( resid   90 and name HN   )   ( resid   90 and name HB2  )   4.00  2.20  1.00
assign ( resid   90 and name HN   )   ( resid   90 and name HG2  )   4.00  2.20  1.00
assign ( resid   90 and name HN   )   ( resid   90 and name HG1  )   3.00  1.20  0.50
assign ( resid   90 and name HN   )   ( resid   90 and name HD*  )   4.00  2.20  1.00
assign ( resid   89 and name HB1  )   ( resid   90 and name HN   )   4.00  2.20  1.00
assign ( resid   89 and name HB2  )   ( resid   90 and name HN   )   4.00  2.20  1.00
assign ( resid   90 and name HN   )   ( resid   91 and name HB1  )   4.00  2.20  1.00
assign ( resid   90 and name HN   )   ( resid   91 and name HA   )   4.00  2.20  1.00
assign ( resid   88 and name HA   )   ( resid   90 and name HN   )   4.00  2.20  1.00
assign ( resid   87 and name HA   )   ( resid   90 and name HN   )   4.00  2.20  1.00
assign ( resid   55 and name HB   )   ( resid   56 and name HN   )   4.00  2.20  1.00
assign ( resid   56 and name HN   )   ( resid   56 and name HD*  )   4.00  2.20  1.00
assign ( resid   56 and name HN   )   ( resid   56 and name HB2  )   3.00  1.20  0.50
assign ( resid   56 and name HN   )   ( resid   56 and name HG1  )   3.00  1.20  0.50
assign ( resid   56 and name HN   )   ( resid   56 and name HG2  )   4.00  2.20  1.00
assign ( resid   55 and name HG2* )   ( resid   56 and name HN   )   4.00  2.20  1.00
assign ( resid   54 and name HA   )   ( resid   57 and name HN   )   4.00  2.20  1.00
assign ( resid   53 and name HA   )   ( resid   57 and name HN   )   4.00  2.20  1.00
assign ( resid   57 and name HN   )   ( resid   57 and name HB1  )   3.00  1.20  0.50
assign ( resid   57 and name HN   )   ( resid   57 and name HB2  )   3.00  1.20  0.50
assign ( resid   56 and name HD*  )   ( resid   57 and name HN   )   4.00  2.20  2.00
assign ( resid   56 and name HB2  )   ( resid   57 and name HN   )   4.00  2.20  1.00
assign ( resid   56 and name HB1  )   ( resid   57 and name HN   )   4.00  2.20  1.00
assign ( resid   54 and name HB*  )   ( resid   57 and name HN   )   4.00  2.20  1.00
assign ( resid   57 and name HN   )   ( resid   60 and name HB*  )   4.00  2.20  1.00
assign ( resid   80 and name HN   )   ( resid   81 and name HN   )   3.00  1.20  0.50
assign ( resid   80 and name HN   )   ( resid   82 and name HN   )   4.00  2.20  1.00
assign ( resid   79 and name HD1  )   ( resid   80 and name HN   )   4.00  2.20  2.00
assign ( resid   79 and name HD2  )   ( resid   80 and name HN   )   4.00  2.20  2.00
assign ( resid   79 and name HB2  )   ( resid   80 and name HN   )   3.00  1.20  0.50
assign ( resid   80 and name HN   )   ( resid   80 and name HG2* )   3.00  1.20  0.50
assign ( resid   33 and name HN   )   ( resid   46 and name HN   )   4.00  2.20  1.00
assign ( resid   45 and name HA   )   ( resid   46 and name HN   )   3.00  1.20  0.50
assign ( resid   34 and name HA   )   ( resid   46 and name HN   )   4.00  2.20  1.00
assign ( resid   45 and name HB1  )   ( resid   46 and name HN   )   4.00  2.20  1.00
assign ( resid   45 and name HB2  )   ( resid   46 and name HN   )   4.00  2.20  1.00
assign ( resid   32 and name HB   )   ( resid   46 and name HN   )   4.00  2.20  1.00
assign ( resid   64 and name HB2  )   ( resid   80 and name HN   )   4.00  2.20  1.00
assign ( resid   91 and name HN   )   ( resid   92 and name HN   )   4.00  2.20  1.00
assign ( resid   89 and name HN   )   ( resid   91 and name HN   )   4.00  2.20  1.00
assign ( resid   90 and name HN   )   ( resid   91 and name HN   )   3.00  1.20  0.50
assign ( resid   90 and name HA   )   ( resid   91 and name HN   )   3.00  1.20  0.50
assign ( resid   88 and name HA   )   ( resid   91 and name HN   )   4.00  2.20  1.00
assign ( resid   91 and name HN   )   ( resid   91 and name HB1  )   4.00  2.20  1.00
assign ( resid   91 and name HN   )   ( resid   91 and name HG1  )   4.00  2.20  1.00
assign ( resid   91 and name HN   )   ( resid   91 and name HG2  )   3.00  1.20  0.50
assign ( resid   90 and name HB2  )   ( resid   91 and name HN   )   4.00  2.20  1.00
assign ( resid   59 and name HN   )   ( resid   61 and name HN   )   4.00  2.20  1.00
assign ( resid   56 and name HA   )   ( resid   59 and name HN   )   4.00  2.20  1.00
assign ( resid   59 and name HN   )   ( resid   59 and name HB*  )   3.00  1.20  0.50
assign ( resid   58 and name HB2  )   ( resid   59 and name HN   )   4.00  2.20  1.00
assign ( resid   58 and name HB1  )   ( resid   59 and name HN   )   4.00  2.20  1.00
assign ( resid   59 and name HN   )   ( resid   60 and name HB*  )   4.00  2.20  1.00
assign ( resid   99 and name HB2  )   ( resid  100 and name HN   )   4.00  2.20  1.00
assign ( resid  100 and name HN   )   ( resid  100 and name HB2  )   3.00  1.20  0.50
assign ( resid  100 and name HN   )   ( resid  100 and name HB1  )   3.00  1.20  0.50
assign ( resid   99 and name HB1  )   ( resid  100 and name HN   )   4.00  2.20  1.00
assign ( resid   99 and name HA   )   ( resid  100 and name HN   )   2.00  0.20  0.70
assign ( resid  100 and name HN   )   ( resid  101 and name HN   )   4.00  2.20  1.00
assign ( resid  101 and name HN   )   ( resid  102 and name HN   )   3.00  1.20  0.50
assign ( resid  100 and name HA   )   ( resid  102 and name HN   )   4.00  2.20  1.00
assign ( resid  100 and name HD*  )   ( resid  102 and name HN   )   4.00  2.20  1.00
assign ( resid  101 and name HB1  )   ( resid  102 and name HN   )   4.00  2.20  1.00
assign ( resid  101 and name HB2  )   ( resid  102 and name HN   )   4.00  2.20  1.00
assign ( resid  102 and name HN   )   ( resid  102 and name HB   )   4.00  2.20  1.00
assign ( resid  102 and name HN   )   ( resid  102 and name HG1* )   3.00  1.20  0.50
assign ( resid  102 and name HN   )   ( resid  102 and name HG2* )   3.00  1.20  0.50
assign ( resid  101 and name HD2  )   ( resid  102 and name HN   )   4.00  2.20  1.00
assign ( resid   10 and name HN   )   ( resid   11 and name HN   )   3.00  1.20  0.50
assign ( resid   17 and name HB2  )   ( resid   18 and name HN   )   4.00  2.20  1.00
assign ( resid   17 and name HB1  )   ( resid   18 and name HN   )   4.00  2.20  1.00
assign ( resid    8 and name HA   )   ( resid   11 and name HN   )   4.00  2.20  1.00
assign ( resid   11 and name HN   )   ( resid   11 and name HG12 )   2.00  0.20  0.70
assign ( resid    9 and name HB*  )   ( resid   11 and name HN   )   4.00  2.20  2.00
assign ( resid   11 and name HN   )   ( resid   11 and name HG11 )   3.00  1.20  0.50
assign ( resid   11 and name HN   )   ( resid   11 and name HG2* )   3.00  1.20  0.50
assign ( resid   11 and name HN   )   ( resid   65 and name HD1* )   4.00  2.20  1.00
assign ( resid    8 and name HG2* )   ( resid   11 and name HN   )   4.00  2.20  2.00
assign ( resid   18 and name HN   )   ( resid   43 and name HG2* )   3.00  1.20  0.50
assign ( resid   18 and name HN   )   ( resid   18 and name HB*  )   3.00  1.20  0.50
assign ( resid    8 and name HG1* )   ( resid   11 and name HN   )   4.00  2.20  2.00
assign ( resid   18 and name HN   )   ( resid   43 and name HG1* )   4.00  2.20  1.00
assign ( resid   18 and name HN   )   ( resid   36 and name HD1* )   4.00  2.20  2.00
assign ( resid   18 and name HN   )   ( resid   43 and name HB   )   4.00  2.20  1.00
assign ( resid   17 and name HN   )   ( resid   18 and name HN   )   3.00  1.20  0.50
assign ( resid   18 and name HN   )   ( resid   19 and name HN   )   4.00  2.20  1.00
assign ( resid   53 and name HN   )   ( resid   54 and name HN   )   3.00  1.20  0.50
assign ( resid   52 and name HN   )   ( resid   53 and name HN   )   4.00  2.20  1.00
assign ( resid   52 and name HA   )   ( resid   53 and name HN   )   3.00  1.20  0.50
assign ( resid   53 and name HN   )   ( resid   53 and name HB1  )   4.00  2.20  1.00
assign ( resid   53 and name HN   )   ( resid   53 and name HB2  )   4.00  2.20  1.00
assign ( resid   44 and name HA1  )   ( resid   53 and name HN   )   4.00  2.20  2.00
assign ( resid   51 and name HB1  )   ( resid   53 and name HN   )   4.00  2.20  1.00
assign ( resid   52 and name HB2  )   ( resid   53 and name HN   )   4.00  2.20  2.00
assign ( resid   52 and name HB1  )   ( resid   53 and name HN   )   4.00  2.20  1.00
assign ( resid   51 and name HB2  )   ( resid   53 and name HN   )   4.00  2.20  1.00
assign ( resid   52 and name HG2  )   ( resid   53 and name HN   )   4.00  2.20  2.00
assign ( resid   38 and name HN   )   ( resid   39 and name HN   )   4.00  2.20  1.00
assign ( resid   39 and name HN   )   ( resid   40 and name HA   )   4.00  2.20  1.00
assign ( resid   37 and name HA   )   ( resid   39 and name HN   )   4.00  2.20  1.00
assign ( resid   39 and name HN   )   ( resid   39 and name HB   )   4.00  2.20  1.00
assign ( resid   39 and name HN   )   ( resid   63 and name HB*  )   4.00  2.20  2.00
assign ( resid   38 and name HB1  )   ( resid   39 and name HN   )   4.00  2.20  1.00
assign ( resid   38 and name HB2  )   ( resid   39 and name HN   )   4.00  2.20  1.00
assign ( resid   14 and name HG1* )   ( resid   39 and name HN   )   4.00  2.20  1.00
assign ( resid   33 and name HN   )   ( resid   34 and name HN   )   4.00  2.20  1.00
assign ( resid   34 and name HN   )   ( resid   70 and name HN   )   4.00  2.20  1.00
assign ( resid   31 and name HD1  )   ( resid   34 and name HN   )   4.00  2.20  2.00
assign ( resid   33 and name HA   )   ( resid   34 and name HN   )   3.00  1.20  0.50
assign ( resid   34 and name HN   )   ( resid   70 and name HB2  )   4.00  2.20  1.00
assign ( resid   34 and name HN   )   ( resid   70 and name HB1  )   4.00  2.20  1.00
assign ( resid   34 and name HN   )   ( resid   34 and name HG   )   4.00  2.20  1.00
assign ( resid   34 and name HN   )   ( resid   34 and name HB1  )   4.00  2.20  1.00
assign ( resid   34 and name HN   )   ( resid   69 and name HB1  )   4.00  2.20  1.00
assign ( resid   34 and name HN   )   ( resid   34 and name HD1* )   4.00  2.20  1.00
assign ( resid   32 and name HG1* )   ( resid   34 and name HN   )   4.00  2.20  2.00
assign ( resid   34 and name HN   )   ( resid   43 and name HG1* )   4.00  2.20  2.00
assign ( resid   34 and name HN   )   ( resid   34 and name HD2* )   4.00  2.20  1.00
assign ( resid   94 and name HN   )   ( resid   95 and name HN   )   4.00  2.20  1.00
assign ( resid   94 and name HA   )   ( resid   95 and name HN   )   3.00  1.20  0.50
assign ( resid   94 and name HB*  )   ( resid   95 and name HN   )   4.00  2.20  1.00
assign ( resid   16 and name HG2  )   ( resid   95 and name HN   )   4.00  2.20  2.00
assign ( resid   16 and name HG1  )   ( resid   95 and name HN   )   4.00  2.20  1.00
assign ( resid   25 and name HN   )   ( resid   28 and name HN   )   4.00  2.20  2.00
assign ( resid   25 and name HN   )   ( resid   29 and name HN   )   4.00  2.20  2.00
assign ( resid   25 and name HN   )   ( resid   27 and name HN   )   4.00  2.20  1.00
assign ( resid   25 and name HN   )   ( resid   31 and name HZ3  )   4.00  2.20  2.00
assign ( resid   24 and name HB1  )   ( resid   25 and name HN   )   4.00  2.20  1.00
assign ( resid   22 and name HA   )   ( resid   25 and name HN   )   4.00  2.20  1.00
assign ( resid   24 and name HB2  )   ( resid   25 and name HN   )   4.00  2.20  1.00
assign ( resid   25 and name HN   )   ( resid   25 and name HB1  )   4.00  2.20  1.00
assign ( resid   25 and name HN   )   ( resid   25 and name HG   )   4.00  2.20  1.00
assign ( resid   25 and name HN   )   ( resid   25 and name HB2  )   4.00  2.20  1.00
assign ( resid   25 and name HN   )   ( resid   25 and name HD1* )   4.00  2.20  1.00
assign ( resid   14 and name HN   )   ( resid   15 and name HN   )   4.00  2.20  1.00
assign ( resid   15 and name HN   )   ( resid   41 and name HN   )   4.00  2.20  2.00
assign ( resid   14 and name HA   )   ( resid   15 and name HN   )   3.00  1.20  0.50
assign ( resid   15 and name HN   )   ( resid   41 and name HA1  )   4.00  2.20  1.00
assign ( resid   15 and name HN   )   ( resid   15 and name HB   )   3.00  1.20  0.50
assign ( resid   15 and name HN   )   ( resid   41 and name HA2  )   4.00  2.20  2.00
assign ( resid   14 and name HB   )   ( resid   15 and name HN   )   3.00  1.20  0.50
assign ( resid   15 and name HN   )   ( resid   15 and name HG2* )   4.00  2.20  1.00
assign ( resid   14 and name HG2* )   ( resid   15 and name HN   )   4.00  2.20  1.00
assign ( resid   14 and name HG1* )   ( resid   15 and name HN   )   4.00  2.20  1.00
assign ( resid   15 and name HN   )   ( resid   36 and name HD1* )   4.00  2.20  1.00
assign ( resid   64 and name HD2  )   ( resid   65 and name HN   )   4.00  2.20  1.00
assign ( resid   64 and name HD1  )   ( resid   65 and name HN   )   4.00  2.20  1.00
assign ( resid   65 and name HN   )   ( resid   79 and name HN   )   4.00  2.20  1.00
assign ( resid   63 and name HA   )   ( resid   65 and name HN   )   4.00  2.20  1.00
assign ( resid   64 and name HB1  )   ( resid   65 and name HN   )   4.00  2.20  1.00
assign ( resid   64 and name HG*  )   ( resid   65 and name HN   )   3.00  1.20  0.50
assign ( resid   64 and name HB2  )   ( resid   65 and name HN   )   4.00  2.20  1.00
assign ( resid   65 and name HN   )   ( resid   65 and name HB   )   4.00  2.20  1.00
assign ( resid   65 and name HN   )   ( resid   65 and name HG12 )   4.00  2.20  1.00
assign ( resid   65 and name HN   )   ( resid   65 and name HG11 )   4.00  2.20  1.00
assign ( resid   11 and name HG2* )   ( resid   65 and name HN   )   4.00  2.20  1.00
assign ( resid   65 and name HN   )   ( resid   65 and name HG2* )   4.00  2.20  1.00
assign ( resid   65 and name HN   )   ( resid   65 and name HD1* )   4.00  2.20  1.00
assign ( resid   88 and name HN   )   ( resid   89 and name HN   )   3.00  1.20  0.50
assign ( resid   87 and name HN   )   ( resid   88 and name HN   )   3.00  1.20  0.50
assign ( resid   88 and name HN   )   ( resid   90 and name HN   )   4.00  2.20  1.00
assign ( resid   75 and name HA   )   ( resid   88 and name HN   )   4.00  2.20  1.00
assign ( resid   87 and name HA   )   ( resid   88 and name HN   )   3.00  1.20  0.50
assign ( resid   88 and name HN   )   ( resid   88 and name HB2  )   4.00  2.20  1.00
assign ( resid   88 and name HN   )   ( resid   88 and name HB1  )   4.00  2.20  1.00
assign ( resid   86 and name HB2  )   ( resid   88 and name HN   )   4.00  2.20  1.00
assign ( resid   44 and name HN   )   ( resid   45 and name HN   )   4.00  2.20  1.00
assign ( resid   43 and name HN   )   ( resid   44 and name HN   )   4.00  2.20  1.00
assign ( resid   34 and name HA   )   ( resid   44 and name HN   )   4.00  2.20  1.00
assign ( resid   36 and name HA   )   ( resid   44 and name HN   )   4.00  2.20  1.00
assign ( resid   43 and name HA   )   ( resid   44 and name HN   )   3.00  1.20  0.50
assign ( resid   44 and name HN   )   ( resid   54 and name HB*  )   4.00  2.20  1.00
assign ( resid   43 and name HB   )   ( resid   44 and name HN   )   4.00  2.20  1.00
assign ( resid   43 and name HG2* )   ( resid   44 and name HN   )   4.00  2.20  1.00
assign ( resid   43 and name HG1* )   ( resid   44 and name HN   )   4.00  2.20  1.00
assign ( resid   62 and name HN   )   ( resid   63 and name HN   )   3.00  1.20  0.50
assign ( resid   61 and name HN   )   ( resid   62 and name HN   )   3.00  1.20  0.50
assign ( resid   58 and name HA   )   ( resid   62 and name HN   )   4.00  2.20  1.00
assign ( resid   59 and name HA   )   ( resid   62 and name HN   )   4.00  2.20  1.00
assign ( resid   61 and name HB   )   ( resid   62 and name HN   )   4.00  2.20  1.00
assign ( resid   60 and name HB*  )   ( resid   62 and name HN   )   4.00  2.20  1.00
assign ( resid   61 and name HG2* )   ( resid   62 and name HN   )   4.00  2.20  1.00
assign ( resid   60 and name HN   )   ( resid   62 and name HN   )   4.00  2.20  1.00
assign ( resid   59 and name HB*  )   ( resid   60 and name HN   )   3.00  1.20  0.50
assign ( resid   60 and name HN   )   ( resid   60 and name HB*  )   3.00  1.20  0.50
assign ( resid   60 and name HN   )   ( resid   61 and name HG2* )   4.00  2.20  2.00
assign ( resid   81 and name HN   )   ( resid   82 and name HN   )   3.00  1.20  0.50
assign ( resid   82 and name HN   )   ( resid   83 and name HN   )   3.00  1.20  0.50
assign ( resid   79 and name HA   )   ( resid   82 and name HN   )   4.00  2.20  1.00
assign ( resid   78 and name HB1  )   ( resid   82 and name HN   )   4.00  2.20  1.00
assign ( resid   82 and name HN   )   ( resid   82 and name HA   )   3.00  1.20  0.50
assign ( resid   78 and name HB2  )   ( resid   82 and name HN   )   4.00  2.20  1.00
assign ( resid   82 and name HN   )   ( resid   82 and name HB2  )   4.00  2.20  1.00
assign ( resid   82 and name HN   )   ( resid   82 and name HG2  )   4.00  2.20  1.00
assign ( resid   82 and name HN   )   ( resid   83 and name HG2* )   4.00  2.20  1.00
assign ( resid   80 and name HG2* )   ( resid   82 and name HN   )   4.00  2.20  1.00
assign ( resid   35 and name HA   )   ( resid   70 and name HN   )   4.00  2.20  1.00
assign ( resid   68 and name HA1  )   ( resid   70 and name HN   )   4.00  2.20  2.00
assign ( resid   69 and name HB2  )   ( resid   70 and name HN   )   4.00  2.20  1.00
assign ( resid   70 and name HN   )   ( resid   70 and name HB2  )   4.00  2.20  1.00
assign ( resid   69 and name HB1  )   ( resid   70 and name HN   )   4.00  2.20  1.00
assign ( resid   34 and name HB2  )   ( resid   70 and name HN   )   4.00  2.20  1.00
assign ( resid   70 and name HN   )   ( resid   70 and name HB1  )   4.00  2.20  1.00
assign ( resid   34 and name HB1  )   ( resid   70 and name HN   )   4.00  2.20  1.00
assign ( resid   39 and name HN   )   ( resid   40 and name HN   )   3.00  1.20  0.50
assign ( resid   39 and name HB   )   ( resid   40 and name HN   )   3.00  1.20  0.50
assign ( resid   40 and name HN   )   ( resid   40 and name HB1  )   4.00  2.20  1.00
assign ( resid   40 and name HN   )   ( resid   40 and name HB2  )   4.00  2.20  1.00
assign ( resid   14 and name HG1* )   ( resid   40 and name HN   )   4.00  2.20  1.00
assign ( resid   39 and name HG2* )   ( resid   40 and name HN   )   4.00  2.20  1.00
assign ( resid   14 and name HG2* )   ( resid   40 and name HN   )   4.00  2.20  1.00
assign ( resid   14 and name HB   )   ( resid   40 and name HN   )   4.00  2.20  2.00
assign ( resid   46 and name HB2  )   ( resid   47 and name HN   )   4.00  2.20  1.00
assign ( resid   47 and name HN   )   ( resid   47 and name HB1  )   4.00  2.20  1.00
assign ( resid   46 and name HB1  )   ( resid   47 and name HN   )   4.00  2.20  1.00
assign ( resid   47 and name HN   )   ( resid   47 and name HB2  )   4.00  2.20  1.00
assign ( resid   27 and name HN   )   ( resid   29 and name HN   )   4.00  2.20  1.00
assign ( resid   29 and name HN   )   ( resid   29 and name HB2  )   4.00  2.20  1.00
assign ( resid   27 and name HB   )   ( resid   29 and name HN   )   4.00  2.20  1.00
assign ( resid   27 and name HG12 )   ( resid   29 and name HN   )   4.00  2.20  1.00
assign ( resid   27 and name HG11 )   ( resid   29 and name HN   )   3.00  1.20  0.50
assign ( resid   27 and name HG2* )   ( resid   29 and name HN   )   4.00  2.20  2.00
assign ( resid   27 and name HD1* )   ( resid   29 and name HN   )   4.00  2.20  1.00
assign ( resid   39 and name HN   )   ( resid   41 and name HN   )   4.00  2.20  1.00
assign ( resid   41 and name HN   )   ( resid   42 and name HN   )   4.00  2.20  1.00
assign ( resid   40 and name HN   )   ( resid   41 and name HN   )   3.00  1.20  0.50
assign ( resid   37 and name HB2  )   ( resid   41 and name HN   )   4.00  2.20  1.00
assign ( resid   14 and name HB   )   ( resid   41 and name HN   )   4.00  2.20  1.00
assign ( resid   14 and name HG1* )   ( resid   41 and name HN   )   4.00  2.20  1.00
assign ( resid   14 and name HG2* )   ( resid   41 and name HN   )   4.00  2.20  1.00
assign ( resid   67 and name HA   )   ( resid   68 and name HN   )   3.00  1.20  0.50
assign ( resid   68 and name HN   )   ( resid   76 and name HA2  )   4.00  2.20  1.00
assign ( resid   67 and name HG1  )   ( resid   68 and name HN   )   4.00  2.20  1.00
assign ( resid   67 and name HG2  )   ( resid   68 and name HN   )   4.00  2.20  1.00
assign ( resid   36 and name HG2* )   ( resid   68 and name HN   )   4.00  2.20  1.00
assign ( resid   27 and name HN   )   ( resid   28 and name HN   )   3.00  1.20  0.50
assign ( resid   26 and name HN   )   ( resid   28 and name HN   )   4.00  2.20  1.00
assign ( resid   25 and name HA   )   ( resid   28 and name HN   )   4.00  2.20  1.00
assign ( resid   27 and name HB   )   ( resid   28 and name HN   )   4.00  2.20  1.00
assign ( resid   25 and name HG   )   ( resid   28 and name HN   )   4.00  2.20  2.00
assign ( resid   26 and name HB*  )   ( resid   28 and name HN   )   4.00  2.20  2.00
assign ( resid   27 and name HG12 )   ( resid   28 and name HN   )   4.00  2.20  1.00
assign ( resid   27 and name HG11 )   ( resid   28 and name HN   )   4.00  2.20  1.00
assign ( resid   27 and name HG2* )   ( resid   28 and name HN   )   4.00  2.20  1.00
assign ( resid   27 and name HD1* )   ( resid   28 and name HN   )   4.00  2.20  1.00
assign ( resid   51 and name HN   )   ( resid   52 and name HA   )   4.00  2.20  1.00
assign ( resid   50 and name HD1  )   ( resid   51 and name HN   )   4.00  2.20  1.00
assign ( resid   49 and name HB1  )   ( resid   51 and name HN   )   4.00  2.20  1.00
assign ( resid   51 and name HN   )   ( resid   51 and name HB1  )   4.00  2.20  1.00
assign ( resid   51 and name HN   )   ( resid   51 and name HB2  )   4.00  2.20  1.00
assign ( resid   51 and name HN   )   ( resid   52 and name HN   )   3.00  1.20  0.50
assign ( resid   52 and name HN   )   ( resid   54 and name HN   )   4.00  2.20  2.00
assign ( resid   52 and name HN   )   ( resid   52 and name HA   )   3.00  1.20  0.50
assign ( resid   47 and name HA   )   ( resid   52 and name HN   )   4.00  2.20  1.00
assign ( resid   51 and name HB1  )   ( resid   52 and name HN   )   4.00  2.20  1.00
assign ( resid   52 and name HN   )   ( resid   52 and name HB2  )   4.00  2.20  1.00
assign ( resid   52 and name HN   )   ( resid   52 and name HG1  )   3.00  1.20  0.50
assign ( resid   52 and name HN   )   ( resid   52 and name HG2  )   3.00  1.20  0.50
assign ( resid    4 and name HN   )   ( resid    5 and name HN   )   4.00  2.20  1.00
assign ( resid    5 and name HN   )   ( resid    7 and name HN   )   4.00  2.20  1.00
assign ( resid    5 and name HN   )   ( resid   85 and name HE2  )   4.00  2.20  1.00
assign ( resid    4 and name HA1  )   ( resid    5 and name HN   )   3.00  1.20  0.50
assign ( resid    4 and name HA2  )   ( resid    5 and name HN   )   3.00  1.20  0.50
assign ( resid    5 and name HN   )   ( resid    5 and name HB1  )   4.00  2.20  1.00
assign ( resid    5 and name HN   )   ( resid    5 and name HB2  )   4.00  2.20  1.00
assign ( resid    5 and name HN   )   ( resid    8 and name HB   )   4.00  2.20  1.00
assign ( resid    5 and name HN   )   ( resid    8 and name HG1* )   4.00  2.20  1.00
assign ( resid    5 and name HN   )   ( resid    8 and name HG2* )   4.00  2.20  1.00
assign ( resid    5 and name HN   )   ( resid   65 and name HD1* )   4.00  2.20  1.00
assign ( resid    5 and name HN   )   ( resid   83 and name HG2* )   4.00  2.20  1.00
assign ( resid   25 and name HN   )   ( resid   26 and name HN   )   3.00  1.20  0.50
assign ( resid   26 and name HN   )   ( resid   27 and name HN   )   3.00  1.20  0.50
assign ( resid   23 and name HA   )   ( resid   26 and name HN   )   4.00  2.20  1.00
assign ( resid   26 and name HN   )   ( resid   26 and name HB*  )   3.00  1.20  0.50
assign ( resid   26 and name HN   )   ( resid   26 and name HG2  )   3.00  1.20  0.50
assign ( resid   25 and name HD1* )   ( resid   26 and name HN   )   4.00  2.20  2.00
assign ( resid   26 and name HN   )   ( resid   27 and name HG2* )   4.00  2.20  1.00
assign ( resid   25 and name HD2* )   ( resid   26 and name HN   )   4.00  2.20  2.00
assign ( resid   26 and name HN   )   ( resid   26 and name HE*  )   4.00  2.20  2.00
assign ( resid   22 and name HA   )   ( resid   26 and name HN   )   4.00  2.20  2.00
assign ( resid   75 and name HN   )   ( resid   75 and name HE1  )   4.00  2.20  1.00
assign ( resid   75 and name HN   )   ( resid   76 and name HN   )   4.00  2.20  1.00
assign ( resid   74 and name HN   )   ( resid   75 and name HN   )   3.00  1.20  0.50
assign ( resid   75 and name HN   )   ( resid   75 and name HD1  )   4.00  2.20  1.00
assign ( resid   75 and name HN   )   ( resid   75 and name HB1  )   4.00  2.20  1.00
assign ( resid   31 and name HN   )   ( resid  101 and name HD2  )   4.00  2.20  1.00
assign ( resid   30 and name HB*  )   ( resid   31 and name HN   )   3.00  1.20  0.50
assign ( resid   82 and name HB2  )   ( resid   83 and name HN   )   4.00  2.20  1.00
assign ( resid   78 and name HB1  )   ( resid   83 and name HN   )   4.00  2.20  1.00
assign ( resid   78 and name HB2  )   ( resid   83 and name HN   )   4.00  2.20  1.00
assign ( resid   83 and name HN   )   ( resid   84 and name HN   )   4.00  2.20  1.00
assign ( resid   24 and name HA   )   ( resid   27 and name HN   )   4.00  2.20  1.00
assign ( resid   27 and name HN   )   ( resid   27 and name HB   )   4.00  2.20  1.00
assign ( resid   26 and name HB*  )   ( resid   27 and name HN   )   4.00  2.20  1.00
assign ( resid   26 and name HG2  )   ( resid   27 and name HN   )   4.00  2.20  1.00
assign ( resid   27 and name HN   )   ( resid   27 and name HG12 )   3.00  1.20  0.50
assign ( resid   27 and name HN   )   ( resid   27 and name HG11 )   4.00  2.20  1.00
assign ( resid   27 and name HN   )   ( resid   27 and name HG2* )   3.00  1.20  0.50
assign ( resid   27 and name HN   )   ( resid   27 and name HD1* )   4.00  2.20  1.00
assign ( resid   12 and name HA   )   ( resid   38 and name HE   )   4.00  2.20  1.00
assign ( resid   38 and name HA   )   ( resid   38 and name HE   )   4.00  2.20  1.00
assign ( resid   13 and name HA   )   ( resid   38 and name HE   )   4.00  2.20  1.00
assign ( resid   38 and name HB1  )   ( resid   38 and name HE   )   4.00  2.20  1.00
assign ( resid   38 and name HB2  )   ( resid   38 and name HE   )   4.00  2.20  1.00
assign ( resid   14 and name HG1* )   ( resid   38 and name HE   )   4.00  2.20  1.00
assign ( resid   95 and name HN   )   ( resid   96 and name HN   )   3.00  1.20  0.50
assign ( resid   95 and name HA   )   ( resid   96 and name HN   )   4.00  2.20  1.00
assign ( resid   94 and name HA   )   ( resid   96 and name HN   )   4.00  2.20  1.00
assign ( resid   96 and name HN   )   ( resid   97 and name HD*  )   4.00  2.20  1.00
assign ( resid   94 and name HB*  )   ( resid   96 and name HN   )   3.00  1.20  0.50
assign ( resid   96 and name HN   )   ( resid   98 and name HD1* )   4.00  2.20  2.00
assign ( resid   76 and name HN   )   ( resid   85 and name HN   )   4.00  2.20  1.00
assign ( resid   75 and name HE3  )   ( resid   76 and name HN   )   4.00  2.20  1.00
assign ( resid   76 and name HN   )   ( resid   84 and name HA   )   4.00  2.20  2.00
assign ( resid   75 and name HA   )   ( resid   76 and name HN   )   3.00  1.20  0.50
assign ( resid   76 and name HN   )   ( resid   86 and name HA   )   4.00  2.20  1.00
assign ( resid   75 and name HB2  )   ( resid   76 and name HN   )   3.00  1.20  0.50
assign ( resid   75 and name HB1  )   ( resid   76 and name HN   )   4.00  2.20  1.00
assign ( resid   76 and name HN   )   ( resid   84 and name HG*  )   4.00  2.20  1.00
assign ( resid   76 and name HN   )   ( resid   84 and name HB*  )   4.00  2.20  2.00
assign ( resid   76 and name HN   )   ( resid   87 and name HG   )   4.00  2.20  1.00
assign ( resid   76 and name HN   )   ( resid   87 and name HD1* )   4.00  2.20  2.00
assign ( resid   65 and name HG2* )   ( resid   76 and name HN   )   4.00  2.20  2.00
assign ( resid   76 and name HN   )   ( resid   87 and name HD2* )   4.00  2.20  2.00
assign ( resid   72 and name HA   )   ( resid   74 and name HN   )   4.00  2.20  2.00
assign ( resid   74 and name HN   )   ( resid   91 and name HE*  )   4.00  2.20  1.00
assign ( resid   74 and name HN   )   ( resid   91 and name HB1  )   4.00  2.20  2.00
assign ( resid   73 and name HB2  )   ( resid   74 and name HN   )   4.00  2.20  1.00
assign ( resid    7 and name HA   )   ( resid   10 and name HN   )   4.00  2.20  1.00
assign ( resid    8 and name HA   )   ( resid   10 and name HN   )   4.00  2.20  1.00
assign ( resid   10 and name HN   )   ( resid   11 and name HG12 )   4.00  2.20  1.00
assign ( resid    9 and name HB*  )   ( resid   10 and name HN   )   3.00  1.20  0.50
assign ( resid   10 and name HN   )   ( resid   11 and name HG2* )   4.00  2.20  1.00
assign ( resid   10 and name HN   )   ( resid   11 and name HG11 )   4.00  2.20  1.00
assign ( resid   20 and name HN   )   ( resid   21 and name HN   )   4.00  2.20  1.00
assign ( resid   19 and name HB1  )   ( resid   20 and name HN   )   4.00  2.20  1.00
assign ( resid   19 and name HB2  )   ( resid   20 and name HN   )   4.00  2.20  1.00
assign ( resid   18 and name HB*  )   ( resid   20 and name HN   )   4.00  2.20  1.00
assign ( resid   20 and name HN   )   ( resid   25 and name HD1* )   4.00  2.20  1.00
assign ( resid   20 and name HN   )   ( resid   98 and name HG2* )   4.00  2.20  1.00
assign ( resid   19 and name HD1* )   ( resid   20 and name HN   )   4.00  2.20  1.00
assign ( resid   20 and name HN   )   ( resid   34 and name HD1* )   4.00  2.20  2.00
assign ( resid   20 and name HN   )   ( resid   25 and name HD2* )   4.00  2.20  1.00
assign ( resid   20 and name HN   )   ( resid   98 and name HD1* )   4.00  2.20  1.00
assign ( resid   19 and name HG   )   ( resid   20 and name HN   )   4.00  2.20  1.00
assign ( resid   60 and name HN   )   ( resid   61 and name HN   )   3.00  1.20  0.50
assign ( resid   59 and name HA   )   ( resid   61 and name HN   )   4.00  2.20  2.00
assign ( resid   61 and name HN   )   ( resid   61 and name HB   )   4.00  2.20  1.00
assign ( resid   60 and name HB*  )   ( resid   61 and name HN   )   3.00  1.20  0.50
assign ( resid   61 and name HN   )   ( resid   61 and name HG2* )   3.00  1.20  0.50
assign ( resid   25 and name HA   )   ( resid   27 and name HN   )   4.00  2.20  1.00
assign ( resid   77 and name HN   )   ( resid   85 and name HZ   )   4.00  2.20  2.00
assign ( resid   77 and name HN   )   ( resid   85 and name HE2  )   4.00  2.20  2.00
assign ( resid   16 and name HD2  )   ( resid   95 and name HD22 )   4.00  2.20  2.00
assign ( resid   16 and name HD2  )   ( resid   95 and name HD21 )   4.00  2.20  2.00
assign ( resid   16 and name HB2  )   ( resid   95 and name HD21 )   4.00  2.20  1.00
assign ( resid   16 and name HB2  )   ( resid   95 and name HD22 )   4.00  2.20  1.00
assign ( resid   11 and name HB   )   ( resid   38 and name HE   )   4.00  2.20  1.00
assign ( resid   58 and name HD1  )   ( resid   59 and name HN   )   4.00  2.20  2.00
assign ( resid   58 and name HD2  )   ( resid   59 and name HN   )   4.00  2.20  2.00
assign ( resid   20 and name HA1  )   ( resid   31 and name HE1  )   4.00  2.20  2.00
assign ( resid    8 and name HN   )   ( resid   10 and name HN   )   4.00  2.20  1.00
assign ( resid    9 and name HN   )   ( resid   10 and name HN   )   2.00  0.20  0.70
assign ( resid   14 and name HG2* )   ( resid   39 and name HN   )   4.00  2.20  1.00
assign ( resid   23 and name HA   )   ( resid   25 and name HN   )   4.00  2.20  1.00
assign ( resid   24 and name HN   )   ( resid   26 and name HN   )   4.00  2.20  1.00
assign ( resid   26 and name HG2  )   ( resid   28 and name HN   )   4.00  2.20  2.00
assign ( resid   26 and name HN   )   ( resid   26 and name HG1  )   4.00  2.20  1.00
assign ( resid   26 and name HN   )   ( resid   27 and name HG12 )   4.00  2.20  1.00
assign ( resid   28 and name HN   )   ( resid   29 and name HN   )   3.00  1.20  0.50
assign ( resid   31 and name HB2  )   ( resid   33 and name HN   )   4.00  2.20  1.00
assign ( resid   35 and name HB*  )   ( resid   44 and name HN   )   4.00  2.20  2.00
assign ( resid   36 and name HN   )   ( resid   37 and name HN   )   4.00  2.20  1.00
assign ( resid   37 and name HB1  )   ( resid   41 and name HN   )   4.00  2.20  1.00
assign ( resid   40 and name HB2  )   ( resid   42 and name HN   )   4.00  2.20  2.00
assign ( resid   40 and name HB1  )   ( resid   41 and name HN   )   4.00  2.20  1.00
assign ( resid   40 and name HB1  )   ( resid   42 and name HN   )   4.00  2.20  2.00
assign ( resid   17 and name HN   )   ( resid   41 and name HA1  )   4.00  2.20  1.00
assign ( resid   37 and name HN   )   ( resid   41 and name HA2  )   4.00  2.20  1.00
assign ( resid   17 and name HN   )   ( resid   42 and name HA   )   4.00  2.20  1.00
assign ( resid   42 and name HB1  )   ( resid   43 and name HN   )   4.00  2.20  1.00
assign ( resid   35 and name HN   )   ( resid   43 and name HA   )   4.00  2.20  2.00
assign ( resid   44 and name HA2  )   ( resid   54 and name HN   )   4.00  2.20  2.00
assign ( resid   49 and name HA   )   ( resid   51 and name HN   )   4.00  2.20  1.00
assign ( resid   49 and name HB2  )   ( resid   51 and name HN   )   4.00  2.20  1.00
assign ( resid   51 and name HB2  )   ( resid   52 and name HN   )   4.00  2.20  1.00
assign ( resid   52 and name HA   )   ( resid   55 and name HN   )   4.00  2.20  1.00
assign ( resid   53 and name HA   )   ( resid   55 and name HN   )   4.00  2.20  1.00
assign ( resid   53 and name HN   )   ( resid   54 and name HB*  )   4.00  2.20  1.00
assign ( resid   55 and name HA   )   ( resid   58 and name HN   )   4.00  2.20  1.00
assign ( resid   54 and name HN   )   ( resid   55 and name HN   )   3.00  1.20  0.50
assign ( resid   54 and name HN   )   ( resid   56 and name HN   )   4.00  2.20  1.00
assign ( resid   54 and name HN   )   ( resid   57 and name HN   )   4.00  2.20  2.00
assign ( resid   58 and name HD1  )   ( resid   63 and name HN   )   4.00  2.20  2.00
assign ( resid   58 and name HD2  )   ( resid   63 and name HN   )   4.00  2.20  2.00
assign ( resid   58 and name HN   )   ( resid   60 and name HN   )   4.00  2.20  1.00
assign ( resid   59 and name HN   )   ( resid   60 and name HN   )   3.00  1.20  0.50
assign ( resid   63 and name HB*  )   ( resid   65 and name HN   )   4.00  2.20  2.00
assign ( resid   10 and name HN   )   ( resid   65 and name HD1* )   4.00  2.20  1.00
assign ( resid   79 and name HN   )   ( resid   79 and name HB1  )   4.00  2.20  1.00
assign ( resid   66 and name HG11 )   ( resid   67 and name HN   )   4.00  2.20  1.00
assign ( resid   66 and name HN   )   ( resid   67 and name HN   )   4.00  2.20  1.00
assign ( resid   35 and name HN   )   ( resid   69 and name HN   )   4.00  2.20  1.00
assign ( resid   69 and name HN   )   ( resid   70 and name HN   )   3.00  1.20  0.50
assign ( resid   73 and name HB1  )   ( resid   74 and name HN   )   4.00  2.20  1.00
assign ( resid   73 and name HN   )   ( resid   74 and name HA1  )   4.00  2.20  2.00
assign ( resid   76 and name HA2  )   ( resid   85 and name HN   )   4.00  2.20  2.00
assign ( resid   66 and name HN   )   ( resid   76 and name HA1  )   4.00  2.20  1.00
assign ( resid   65 and name HN   )   ( resid   78 and name HA   )   4.00  2.20  1.00
assign ( resid   78 and name HB1  )   ( resid   80 and name HN   )   4.00  2.20  1.00
assign ( resid   82 and name HN   )   ( resid   83 and name HG1* )   4.00  2.20  1.00
assign ( resid   86 and name HB1  )   ( resid   88 and name HN   )   4.00  2.20  1.00
assign ( resid   87 and name HA   )   ( resid   89 and name HN   )   4.00  2.20  1.00
assign ( resid   89 and name HA   )   ( resid   91 and name HN   )   4.00  2.20  1.00
assign ( resid   85 and name HB2  )   ( resid   85 and name HD1  )   3.00  1.20  0.50
assign ( resid   85 and name HB1  )   ( resid   85 and name HD2  )   4.00  2.20  1.00
assign ( resid   83 and name HG2* )   ( resid   85 and name HD2  )   3.00  1.20  0.50
assign ( resid   30 and name HA   )   ( resid  101 and name HD2  )   4.00  2.20  1.00
assign ( resid   79 and name HA   )   ( resid   79 and name HE1  )   4.00  2.20  1.00
assign ( resid   75 and name HB1  )   ( resid   75 and name HD1  )   4.00  2.20  1.00
assign ( resid   73 and name HB1  )   ( resid   75 and name HD1  )   4.00  2.20  1.00
assign ( resid   73 and name HB2  )   ( resid   75 and name HD1  )   4.00  2.20  1.00
assign ( resid   75 and name HZ3  )   ( resid   77 and name HB1  )   4.00  2.20  1.00
assign ( resid   77 and name HZ2  )   ( resid   82 and name HA   )   4.00  2.20  1.00
assign ( resid   77 and name HZ2  )   ( resid   82 and name HB1  )   4.00  2.20  1.00
assign ( resid   77 and name HZ2  )   ( resid   82 and name HG2  )   4.00  2.20  1.00
assign ( resid   77 and name HD1  )   ( resid   79 and name HE1  )   4.00  2.20  2.00
assign ( resid   77 and name HD1  )   ( resid   79 and name HE2  )   4.00  2.20  2.00
assign ( resid   77 and name HH2  )   ( resid   82 and name HB1  )   4.00  2.20  1.00
assign ( resid   31 and name HZ2  )   ( resid   99 and name HD1  )   4.00  2.20  1.00
assign ( resid   20 and name HA1  )   ( resid   31 and name HZ2  )   4.00  2.20  1.00
assign ( resid   31 and name HB1  )   ( resid   31 and name HE3  )   4.00  2.20  1.00
assign ( resid   24 and name HB2  )   ( resid   31 and name HE3  )   4.00  2.20  1.00
assign ( resid   76 and name HA1  )   ( resid   85 and name HE1  )   4.00  2.20  1.00
assign ( resid   76 and name HA1  )   ( resid   85 and name HE2  )   4.00  2.20  2.00
assign ( resid   65 and name HG11 )   ( resid   85 and name HE2  )   4.00  2.20  2.00
assign ( resid   85 and name HE1  )   ( resid   87 and name HD1* )   4.00  2.20  1.00
assign ( resid    8 and name HB   )   ( resid   85 and name HE1  )   4.00  2.20  1.00
assign ( resid    8 and name HB   )   ( resid   85 and name HE2  )   4.00  2.20  2.00
assign ( resid   65 and name HG12 )   ( resid   85 and name HE2  )   4.00  2.20  1.00
assign ( resid   58 and name HD1  )   ( resid   79 and name HD2  )   4.00  2.20  2.00
assign ( resid   58 and name HD2  )   ( resid   79 and name HD2  )   4.00  2.20  2.00
assign ( resid   58 and name HE1  )   ( resid   64 and name HA   )   4.00  2.20  1.00
assign ( resid   58 and name HE2  )   ( resid   64 and name HA   )   4.00  2.20  1.00
assign ( resid    7 and name HA   )   ( resid    7 and name HD2  )   4.00  2.20  1.00
assign ( resid    7 and name HD2  )   ( resid   64 and name HG*  )   4.00  2.20  1.00
assign ( resid    7 and name HE1  )   ( resid   81 and name HA   )   4.00  2.20  2.00
assign ( resid    6 and name HD*  )   ( resid    7 and name HE1  )   4.00  2.20  2.00
assign ( resid    7 and name HE1  )   ( resid   80 and name HB   )   4.00  2.20  1.00
assign ( resid    7 and name HE1  )   ( resid   80 and name HG2* )   3.00  1.20  0.50
assign ( resid   31 and name HD1  )   ( resid   70 and name HB2  )   4.00  2.20  1.00
assign ( resid   31 and name HZ2  )   ( resid   34 and name HD1* )   4.00  2.20  2.00
assign ( resid   20 and name HA1  )   ( resid   31 and name HH2  )   4.00  2.20  1.00
assign ( resid   24 and name HA   )   ( resid   51 and name HE1  )   4.00  2.20  1.00
assign ( resid   26 and name HD*  )   ( resid   51 and name HE1  )   4.00  2.20  1.00
assign ( resid   27 and name HD1* )   ( resid   51 and name HE1  )   4.00  2.20  1.00
assign ( resid   27 and name HG12 )   ( resid   51 and name HE1  )   4.00  2.20  1.00
assign ( resid   53 and name HD2  )   ( resid   56 and name HB2  )   4.00  2.20  1.00
assign ( resid   23 and name HG*  )   ( resid   51 and name HE1  )   4.00  2.20  1.00
assign ( resid   57 and name HE1  )   ( resid   61 and name HG2* )   3.00  1.20  0.50
assign ( resid   63 and name HA   )   ( resid   63 and name HD2  )   3.00  1.20  0.50
assign ( resid   57 and name HE1  )   ( resid   63 and name HE1  )   4.00  2.20  1.00
assign ( resid   40 and name HA   )   ( resid   63 and name HE1  )   4.00  2.20  1.00
assign ( resid   40 and name HB1  )   ( resid   63 and name HE1  )   3.00  1.20  0.50
assign ( resid   40 and name HB2  )   ( resid   63 and name HE1  )   4.00  2.20  1.00
assign ( resid   61 and name HG2* )   ( resid   63 and name HE1  )   3.00  1.20  0.50
assign ( resid    1 and name HA   )   ( resid    1 and name HG*  )   4.00  2.20  1.00
assign ( resid    1 and name HG*  )   ( resid    2 and name HA   )   4.00  2.20  1.00
assign ( resid    3 and name HA   )   ( resid    3 and name HG*  )   4.00  2.20  1.00
assign ( resid    4 and name HA*  )   ( resid    8 and name HG*  )   4.00  2.20  1.00
assign ( resid    4 and name HA*  )   ( resid   83 and name HG2* )   4.00  2.20  1.00
assign ( resid    4 and name HA*  )   ( resid   85 and name HB2  )   4.00  2.20  1.00
assign ( resid    4 and name HA*  )   ( resid   85 and name HB1  )   4.00  2.20  1.00
assign ( resid    4 and name HA*  )   ( resid   85 and name HD2  )   4.00  2.20  1.00
assign ( resid    5 and name HN   )   ( resid    8 and name HG*  )   3.00  1.20  0.50
assign ( resid    5 and name HB*  )   ( resid   65 and name HD1* )   4.00  2.20  1.00
assign ( resid    5 and name HB*  )   ( resid   81 and name HB*  )   4.00  2.20  1.00
assign ( resid    5 and name HB*  )   ( resid   83 and name HG1* )   4.00  2.20  1.00
assign ( resid    5 and name HB*  )   ( resid   83 and name HG2* )   4.00  2.20  1.00
assign ( resid    6 and name HA   )   ( resid    6 and name HG*  )   4.00  2.20  1.00
assign ( resid    6 and name HG*  )   ( resid    7 and name HN   )   4.00  2.20  1.00
assign ( resid    6 and name HG*  )   ( resid    7 and name HE1  )   4.00  2.20  1.00
assign ( resid    7 and name HN   )   ( resid    7 and name HB*  )   3.00  1.20  0.50
assign ( resid    7 and name HN   )   ( resid    8 and name HG*  )   4.00  2.20  1.00
assign ( resid    7 and name HB*  )   ( resid    8 and name HN   )   4.00  2.20  1.00
assign ( resid    7 and name HB*  )   ( resid    8 and name HG*  )   4.00  2.20  1.00
assign ( resid    7 and name HB*  )   ( resid   64 and name HB2  )   4.00  2.20  1.00
assign ( resid    7 and name HB*  )   ( resid   64 and name HG*  )   4.00  2.20  1.00
assign ( resid    7 and name HB*  )   ( resid   65 and name HB   )   4.00  2.20  2.00
assign ( resid    7 and name HB*  )   ( resid   65 and name HG11 )   4.00  2.20  1.00
assign ( resid    8 and name HN   )   ( resid    8 and name HG*  )   3.00  1.20  0.50
assign ( resid    8 and name HA   )   ( resid    8 and name HG*  )   3.00  1.20  0.50
assign ( resid    8 and name HA   )   ( resid   87 and name HD*  )   4.00  2.20  2.00
assign ( resid    8 and name HG*  )   ( resid    9 and name HN   )   4.00  2.20  1.00
assign ( resid    8 and name HG*  )   ( resid    9 and name HA   )   4.00  2.20  1.00
assign ( resid    8 and name HG*  )   ( resid   11 and name HN   )   4.00  2.20  1.00
assign ( resid    8 and name HG*  )   ( resid   11 and name HG12 )   4.00  2.20  1.00
assign ( resid    8 and name HG*  )   ( resid   11 and name HD1* )   3.00  1.20  0.50
assign ( resid    8 and name HG*  )   ( resid   65 and name HD1* )   3.00  1.20  0.50
assign ( resid    8 and name HG*  )   ( resid   85 and name HD1  )   4.00  2.20  1.00
assign ( resid    8 and name HG*  )   ( resid   85 and name HE1  )   4.00  2.20  1.00
assign ( resid    8 and name HG*  )   ( resid   85 and name HZ   )   4.00  2.20  1.00
assign ( resid    9 and name HB*  )   ( resid   10 and name HA*  )   4.00  2.20  1.00
assign ( resid   10 and name HA*  )   ( resid   11 and name HA   )   4.00  2.20  1.00
assign ( resid   10 and name HA*  )   ( resid   65 and name HD1* )   4.00  2.20  2.00
assign ( resid   11 and name HB   )   ( resid   87 and name HD*  )   4.00  2.20  2.00
assign ( resid   11 and name HD1* )   ( resid   87 and name HD*  )   2.00  0.20  0.70
assign ( resid   14 and name HG2* )   ( resid   37 and name HB*  )   4.00  2.20  1.00
assign ( resid   15 and name HG2* )   ( resid   95 and name HD2* )   4.00  2.20  1.00
assign ( resid   16 and name HA   )   ( resid   17 and name HB*  )   4.00  2.20  2.00
assign ( resid   16 and name HB2  )   ( resid   95 and name HD2* )   4.00  2.20  1.00
assign ( resid   16 and name HB1  )   ( resid   95 and name HD2* )   4.00  2.20  2.00
assign ( resid   16 and name HG2  )   ( resid   95 and name HD2* )   4.00  2.20  1.00
assign ( resid   16 and name HD2  )   ( resid   95 and name HB*  )   4.00  2.20  1.00
assign ( resid   16 and name HD2  )   ( resid   95 and name HD2* )   4.00  2.20  1.00
assign ( resid   17 and name HN   )   ( resid   17 and name HB*  )   3.00  1.20  0.50
assign ( resid   17 and name HN   )   ( resid   95 and name HD2* )   4.00  2.20  2.00
assign ( resid   17 and name HB*  )   ( resid   18 and name HN   )   4.00  2.20  1.00
assign ( resid   17 and name HB*  )   ( resid   42 and name HA   )   4.00  2.20  1.00
assign ( resid   17 and name HB*  )   ( resid   43 and name HN   )   4.00  2.20  1.00
assign ( resid   17 and name HB*  )   ( resid   43 and name HG2* )   4.00  2.20  1.00
assign ( resid   18 and name HN   )   ( resid   19 and name HD*  )   4.00  2.20  2.00
assign ( resid   18 and name HN   )   ( resid   95 and name HD2* )   4.00  2.20  1.00
assign ( resid   18 and name HA   )   ( resid   19 and name HD*  )   4.00  2.20  1.00
assign ( resid   18 and name HA   )   ( resid   95 and name HD2* )   4.00  2.20  2.00
assign ( resid   18 and name HB*  )   ( resid   19 and name HD*  )   4.00  2.20  1.00
assign ( resid   18 and name HB*  )   ( resid   22 and name HG*  )   3.00  1.20  0.50
assign ( resid   18 and name HB*  )   ( resid   25 and name HD*  )   3.00  1.20  0.50
assign ( resid   18 and name HB*  )   ( resid   95 and name HD2* )   4.00  2.20  2.00
assign ( resid   19 and name HN   )   ( resid   19 and name HD*  )   3.00  1.20  0.50
assign ( resid   19 and name HN   )   ( resid   25 and name HD*  )   4.00  2.20  1.00
assign ( resid   19 and name HA   )   ( resid   19 and name HD*  )   3.00  1.20  0.50
assign ( resid   19 and name HB2  )   ( resid   19 and name HD*  )   3.00  1.20  0.50
assign ( resid   19 and name HB2  )   ( resid   98 and name HG1* )   4.00  2.20  1.00
assign ( resid   19 and name HB1  )   ( resid   19 and name HD*  )   3.00  1.20  0.50
assign ( resid   19 and name HB1  )   ( resid   98 and name HG1* )   4.00  2.20  1.00
assign ( resid   19 and name HG   )   ( resid   96 and name HA*  )   4.00  2.20  2.00
assign ( resid   19 and name HD*  )   ( resid   20 and name HN   )   4.00  2.20  1.00
assign ( resid   19 and name HD*  )   ( resid   95 and name HN   )   4.00  2.20  1.00
assign ( resid   19 and name HD*  )   ( resid   95 and name HD2* )   4.00  2.20  1.00
assign ( resid   19 and name HD*  )   ( resid   96 and name HN   )   4.00  2.20  1.00
assign ( resid   19 and name HD*  )   ( resid   96 and name HA*  )   3.00  1.20  0.50
assign ( resid   19 and name HD*  )   ( resid   97 and name HB*  )   4.00  2.20  2.00
assign ( resid   19 and name HD*  )   ( resid   97 and name HG*  )   4.00  2.20  2.00
assign ( resid   19 and name HD*  )   ( resid   97 and name HD*  )   3.00  1.20  0.50
assign ( resid   19 and name HD*  )   ( resid   98 and name HA   )   4.00  2.20  1.00
assign ( resid   19 and name HD*  )   ( resid   98 and name HD1* )   4.00  2.20  1.00
assign ( resid   20 and name HN   )   ( resid   25 and name HD*  )   3.00  1.20  0.50
assign ( resid   20 and name HN   )   ( resid   34 and name HD*  )   4.00  2.20  1.00
assign ( resid   20 and name HA2  )   ( resid   25 and name HD*  )   4.00  2.20  2.00
assign ( resid   20 and name HA2  )   ( resid   34 and name HD*  )   4.00  2.20  1.00
assign ( resid   20 and name HA2  )   ( resid   98 and name HG1* )   4.00  2.20  2.00
assign ( resid   20 and name HA1  )   ( resid   25 and name HD*  )   4.00  2.20  1.00
assign ( resid   20 and name HA1  )   ( resid   34 and name HD*  )   4.00  2.20  1.00
assign ( resid   21 and name HN   )   ( resid   21 and name HB*  )   3.00  1.20  0.50
assign ( resid   21 and name HN   )   ( resid   34 and name HD*  )   4.00  2.20  1.00
assign ( resid   21 and name HA   )   ( resid   34 and name HD*  )   4.00  2.20  1.00
assign ( resid   21 and name HB*  )   ( resid   24 and name HN   )   4.00  2.20  1.00
assign ( resid   21 and name HB*  )   ( resid   24 and name HA   )   4.00  2.20  2.00
assign ( resid   21 and name HB*  )   ( resid   24 and name HB*  )   4.00  2.20  1.00
assign ( resid   21 and name HB*  )   ( resid   25 and name HN   )   4.00  2.20  1.00
assign ( resid   21 and name HB*  )   ( resid   31 and name HB1  )   4.00  2.20  1.00
assign ( resid   21 and name HB*  )   ( resid   31 and name HE3  )   4.00  2.20  2.00
assign ( resid   21 and name HB*  )   ( resid   34 and name HD*  )   3.00  1.20  0.50
assign ( resid   21 and name HB*  )   ( resid   45 and name HN   )   4.00  2.20  1.00
assign ( resid   22 and name HN   )   ( resid   22 and name HG*  )   4.00  2.20  1.00
assign ( resid   22 and name HA   )   ( resid   25 and name HB*  )   4.00  2.20  1.00
assign ( resid   22 and name HA   )   ( resid   25 and name HD*  )   3.00  1.20  0.50
assign ( resid   23 and name HB*  )   ( resid   24 and name HN   )   4.00  2.20  1.00
assign ( resid   23 and name HB*  )   ( resid   51 and name HE1  )   4.00  2.20  1.00
assign ( resid   24 and name HN   )   ( resid   24 and name HB*  )   3.00  1.20  0.50
assign ( resid   24 and name HA   )   ( resid   29 and name HB*  )   4.00  2.20  1.00
assign ( resid   24 and name HB*  )   ( resid   26 and name HN   )   4.00  2.20  2.00
assign ( resid   24 and name HB*  )   ( resid   27 and name HN   )   4.00  2.20  2.00
assign ( resid   24 and name HB*  )   ( resid   27 and name HG12 )   4.00  2.20  2.00
assign ( resid   24 and name HB*  )   ( resid   29 and name HN   )   4.00  2.20  1.00
assign ( resid   24 and name HB*  )   ( resid   31 and name HE3  )   4.00  2.20  1.00
assign ( resid   24 and name HB*  )   ( resid   31 and name HZ3  )   4.00  2.20  1.00
assign ( resid   25 and name HN   )   ( resid   25 and name HB*  )   3.00  1.20  0.50
assign ( resid   25 and name HN   )   ( resid   25 and name HD*  )   4.00  2.20  1.00
assign ( resid   25 and name HA   )   ( resid   25 and name HD*  )   3.00  1.20  0.50
assign ( resid   25 and name HA   )   ( resid   28 and name HA*  )   4.00  2.20  1.00
assign ( resid   25 and name HB*  )   ( resid   25 and name HD*  )   2.00  0.20  0.70
assign ( resid   25 and name HB*  )   ( resid   26 and name HN   )   3.00  1.20  0.50
assign ( resid   25 and name HD*  )   ( resid   26 and name HN   )   4.00  2.20  1.00
assign ( resid   25 and name HD*  )   ( resid   31 and name HZ2  )   4.00  2.20  1.00
assign ( resid   25 and name HD*  )   ( resid   31 and name HH2  )   3.00  1.20  0.50
assign ( resid   25 and name HD*  )   ( resid   99 and name HG*  )   4.00  2.20  1.00
assign ( resid   27 and name HN   )   ( resid   28 and name HA*  )   4.00  2.20  2.00
assign ( resid   27 and name HG2* )   ( resid   29 and name HB*  )   4.00  2.20  2.00
assign ( resid   27 and name HG11 )   ( resid   29 and name HB*  )   4.00  2.20  1.00
assign ( resid   27 and name HD1* )   ( resid   29 and name HB*  )   3.00  1.20  0.50
assign ( resid   28 and name HA*  )   ( resid   29 and name HN   )   3.00  1.20  0.50
assign ( resid   29 and name HN   )   ( resid   29 and name HB*  )   3.00  1.20  0.50
assign ( resid   29 and name HA   )   ( resid   30 and name HG*  )   4.00  2.20  1.00
assign ( resid   29 and name HB*  )   ( resid   30 and name HD*  )   4.00  2.20  1.00
assign ( resid   30 and name HB*  )   ( resid  101 and name HB*  )   4.00  2.20  1.00
assign ( resid   30 and name HD*  )   ( resid   31 and name HN   )   4.00  2.20  1.00
assign ( resid   31 and name HN   )   ( resid  101 and name HB*  )   4.00  2.20  1.00
assign ( resid   31 and name HA   )   ( resid   45 and name HB*  )   4.00  2.20  1.00
assign ( resid   31 and name HB2  )   ( resid   34 and name HD*  )   4.00  2.20  1.00
assign ( resid   31 and name HB1  )   ( resid   34 and name HD*  )   4.00  2.20  1.00
assign ( resid   31 and name HD1  )   ( resid   34 and name HD*  )   4.00  2.20  1.00
assign ( resid   31 and name HE1  )   ( resid   34 and name HD*  )   3.00  1.20  0.50
assign ( resid   31 and name HZ3  )   ( resid   34 and name HD*  )   4.00  2.20  2.00
assign ( resid   31 and name HZ2  )   ( resid   34 and name HD*  )   4.00  2.20  1.00
assign ( resid   31 and name HZ2  )   ( resid   99 and name HB*  )   4.00  2.20  1.00
assign ( resid   31 and name HZ2  )   ( resid   99 and name HG*  )   4.00  2.20  1.00
assign ( resid   31 and name HZ2  )   ( resid   99 and name HD*  )   4.00  2.20  1.00
assign ( resid   31 and name HH2  )   ( resid   34 and name HD*  )   4.00  2.20  2.00
assign ( resid   31 and name HH2  )   ( resid   99 and name HB*  )   4.00  2.20  2.00
assign ( resid   31 and name HH2  )   ( resid   99 and name HG*  )   4.00  2.20  1.00
assign ( resid   31 and name HH2  )   ( resid   99 and name HD*  )   4.00  2.20  2.00
assign ( resid   32 and name HN   )   ( resid   45 and name HB*  )   4.00  2.20  1.00
assign ( resid   32 and name HN   )   ( resid   49 and name HB*  )   4.00  2.20  1.00
assign ( resid   32 and name HA   )   ( resid  102 and name HG*  )   3.00  1.20  0.50
assign ( resid   32 and name HG1* )   ( resid   33 and name HB*  )   4.00  2.20  1.00
assign ( resid   32 and name HG1* )   ( resid   49 and name HB*  )   4.00  2.20  2.00
assign ( resid   32 and name HG1* )   ( resid  102 and name HG*  )   3.00  1.20  0.50
assign ( resid   32 and name HG2* )   ( resid   49 and name HB*  )   4.00  2.20  1.00
assign ( resid   32 and name HG2* )   ( resid  102 and name HG*  )   4.00  2.20  1.00
assign ( resid   33 and name HN   )   ( resid   33 and name HB*  )   3.00  1.20  0.50
assign ( resid   33 and name HN   )   ( resid   46 and name HB*  )   4.00  2.20  1.00
assign ( resid   33 and name HB*  )   ( resid   34 and name HN   )   3.00  1.20  0.50
assign ( resid   33 and name HB*  )   ( resid   46 and name HN   )   4.00  2.20  1.00
assign ( resid   33 and name HB*  )   ( resid   46 and name HB*  )   4.00  2.20  1.00
assign ( resid   33 and name HB*  )   ( resid   70 and name HN   )   4.00  2.20  2.00
assign ( resid   34 and name HN   )   ( resid   34 and name HD*  )   4.00  2.20  1.00
assign ( resid   34 and name HN   )   ( resid   46 and name HB*  )   4.00  2.20  2.00
assign ( resid   34 and name HN   )   ( resid   71 and name HD*  )   4.00  2.20  1.00
assign ( resid   34 and name HA   )   ( resid   34 and name HD*  )   3.00  1.20  0.50
assign ( resid   34 and name HD*  )   ( resid   35 and name HN   )   4.00  2.20  1.00
assign ( resid   34 and name HD*  )   ( resid   43 and name HG1* )   3.00  1.20  0.50
assign ( resid   34 and name HD*  )   ( resid   43 and name HG2* )   4.00  2.20  2.00
assign ( resid   34 and name HD*  )   ( resid   44 and name HN   )   4.00  2.20  1.00
assign ( resid   34 and name HD*  )   ( resid   45 and name HN   )   4.00  2.20  1.00
assign ( resid   34 and name HD*  )   ( resid   45 and name HA   )   3.00  1.20  0.50
assign ( resid   34 and name HD*  )   ( resid   45 and name HB*  )   4.00  2.20  1.00
assign ( resid   34 and name HD*  )   ( resid   46 and name HN   )   4.00  2.20  1.00
assign ( resid   34 and name HD*  )   ( resid   69 and name HB1  )   4.00  2.20  1.00
assign ( resid   34 and name HD*  )   ( resid   70 and name HN   )   4.00  2.20  1.00
assign ( resid   34 and name HD*  )   ( resid   70 and name HB2  )   4.00  2.20  1.00
assign ( resid   34 and name HD*  )   ( resid   98 and name HG2* )   3.00  1.20  0.50
assign ( resid   34 and name HD*  )   ( resid   98 and name HD1* )   4.00  2.20  1.00
assign ( resid   35 and name HN   )   ( resid   35 and name HD*  )   4.00  2.20  1.00
assign ( resid   35 and name HA   )   ( resid   35 and name HD*  )   4.00  2.20  1.00
assign ( resid   35 and name HG*  )   ( resid   36 and name HN   )   4.00  2.20  1.00
assign ( resid   35 and name HG*  )   ( resid   46 and name HA   )   4.00  2.20  2.00
assign ( resid   35 and name HG*  )   ( resid   54 and name HB*  )   4.00  2.20  1.00
assign ( resid   35 and name HG*  )   ( resid   66 and name HD1* )   4.00  2.20  1.00
assign ( resid   35 and name HD*  )   ( resid   46 and name HA   )   4.00  2.20  1.00
assign ( resid   35 and name HD*  )   ( resid   54 and name HB*  )   4.00  2.20  1.00
assign ( resid   35 and name HD*  )   ( resid   66 and name HD1* )   4.00  2.20  1.00
assign ( resid   36 and name HG2* )   ( resid   67 and name HB*  )   3.00  1.20  0.50
assign ( resid   36 and name HD1* )   ( resid   67 and name HB*  )   4.00  2.20  2.00
assign ( resid   37 and name HN   )   ( resid   37 and name HB*  )   3.00  1.20  0.50
assign ( resid   37 and name HN   )   ( resid   42 and name HB*  )   4.00  2.20  1.00
assign ( resid   37 and name HB*  )   ( resid   39 and name HN   )   3.00  1.20  0.50
assign ( resid   37 and name HB*  )   ( resid   40 and name HN   )   3.00  1.20  0.50
assign ( resid   37 and name HB*  )   ( resid   40 and name HB1  )   4.00  2.20  1.00
assign ( resid   37 and name HB*  )   ( resid   41 and name HN   )   3.00  1.20  0.50
assign ( resid   37 and name HB*  )   ( resid   42 and name HN   )   3.00  1.20  0.50
assign ( resid   37 and name HB*  )   ( resid   42 and name HA   )   4.00  2.20  2.00
assign ( resid   37 and name HB*  )   ( resid   42 and name HB*  )   4.00  2.20  1.00
assign ( resid   37 and name HB*  )   ( resid   66 and name HG2* )   4.00  2.20  1.00
assign ( resid   38 and name HB2  )   ( resid   87 and name HD*  )   4.00  2.20  2.00
assign ( resid   38 and name HD2  )   ( resid   67 and name HG*  )   4.00  2.20  1.00
assign ( resid   38 and name HD1  )   ( resid   67 and name HB*  )   4.00  2.20  1.00
assign ( resid   38 and name HD1  )   ( resid   67 and name HG*  )   4.00  2.20  1.00
assign ( resid   38 and name HD1  )   ( resid   87 and name HD*  )   4.00  2.20  1.00
assign ( resid   38 and name HE   )   ( resid   87 and name HD*  )   4.00  2.20  2.00
assign ( resid   42 and name HN   )   ( resid   42 and name HB*  )   3.00  1.20  0.50
assign ( resid   42 and name HB*  )   ( resid   43 and name HN   )   4.00  2.20  1.00
assign ( resid   43 and name HG2* )   ( resid   95 and name HD2* )   4.00  2.20  1.00
assign ( resid   45 and name HN   )   ( resid   45 and name HB*  )   3.00  1.20  0.50
assign ( resid   45 and name HN   )   ( resid   53 and name HB*  )   3.00  1.20  0.50
assign ( resid   45 and name HB*  )   ( resid   46 and name HN   )   4.00  2.20  1.00
assign ( resid   45 and name HB*  )   ( resid   49 and name HN   )   4.00  2.20  1.00
assign ( resid   45 and name HB*  )   ( resid   49 and name HB*  )   4.00  2.20  1.00
assign ( resid   46 and name HN   )   ( resid   46 and name HB*  )   3.00  1.20  0.50
assign ( resid   46 and name HB*  )   ( resid   47 and name HN   )   3.00  1.20  0.50
assign ( resid   46 and name HB*  )   ( resid   48 and name HN   )   4.00  2.20  1.00
assign ( resid   46 and name HB*  )   ( resid   49 and name HN   )   4.00  2.20  1.00
assign ( resid   47 and name HN   )   ( resid   47 and name HB*  )   4.00  2.20  1.00
assign ( resid   47 and name HA   )   ( resid   52 and name HD*  )   3.00  1.20  0.50
assign ( resid   47 and name HB*  )   ( resid   48 and name HN   )   4.00  2.20  1.00
assign ( resid   47 and name HB*  )   ( resid   49 and name HN   )   4.00  2.20  2.00
assign ( resid   49 and name HN   )   ( resid   49 and name HB*  )   3.00  1.20  0.50
assign ( resid   49 and name HB*  )   ( resid   50 and name HD2  )   3.00  1.20  0.50
assign ( resid   49 and name HB*  )   ( resid   50 and name HD1  )   4.00  2.20  1.00
assign ( resid   49 and name HB*  )   ( resid   51 and name HN   )   4.00  2.20  1.00
assign ( resid   49 and name HB*  )   ( resid   52 and name HN   )   4.00  2.20  1.00
assign ( resid   50 and name HB*  )   ( resid   51 and name HN   )   4.00  2.20  1.00
assign ( resid   50 and name HG*  )   ( resid   51 and name HN   )   4.00  2.20  1.00
assign ( resid   51 and name HN   )   ( resid   51 and name HB*  )   3.00  1.20  0.50
assign ( resid   51 and name HB*  )   ( resid   51 and name HE1  )   4.00  2.20  1.00
assign ( resid   51 and name HB*  )   ( resid   52 and name HN   )   3.00  1.20  0.50
assign ( resid   51 and name HB*  )   ( resid   52 and name HA   )   4.00  2.20  2.00
assign ( resid   51 and name HB*  )   ( resid   53 and name HN   )   4.00  2.20  1.00
assign ( resid   52 and name HA   )   ( resid   52 and name HD*  )   4.00  2.20  1.00
assign ( resid   52 and name HA   )   ( resid   52 and name HE*  )   4.00  2.20  1.00
assign ( resid   52 and name HB2  )   ( resid   52 and name HD*  )   3.00  1.20  0.50
assign ( resid   52 and name HB2  )   ( resid   52 and name HE*  )   4.00  2.20  1.00
assign ( resid   52 and name HB1  )   ( resid   52 and name HD*  )   3.00  1.20  0.50
assign ( resid   52 and name HB1  )   ( resid   52 and name HE*  )   4.00  2.20  1.00
assign ( resid   52 and name HG2  )   ( resid   52 and name HE*  )   3.00  1.20  0.50
assign ( resid   52 and name HG1  )   ( resid   52 and name HE*  )   3.00  1.20  0.50
assign ( resid   52 and name HD*  )   ( resid   55 and name HG2* )   4.00  2.20  1.00
assign ( resid   53 and name HN   )   ( resid   53 and name HB*  )   3.00  1.20  0.50
assign ( resid   53 and name HB*  )   ( resid   54 and name HN   )   4.00  2.20  1.00
assign ( resid   57 and name HB*  )   ( resid   58 and name HN   )   4.00  2.20  1.00
assign ( resid   63 and name HN   )   ( resid   64 and name HD*  )   4.00  2.20  1.00
assign ( resid   63 and name HB*  )   ( resid   64 and name HD*  )   4.00  2.20  1.00
assign ( resid   63 and name HD2  )   ( resid   64 and name HD*  )   4.00  2.20  1.00
assign ( resid   64 and name HD*  )   ( resid   65 and name HN   )   4.00  2.20  1.00
assign ( resid   64 and name HD*  )   ( resid   65 and name HD1* )   4.00  2.20  2.00
assign ( resid   66 and name HN   )   ( resid   87 and name HD*  )   4.00  2.20  2.00
assign ( resid   66 and name HA   )   ( resid   67 and name HB*  )   4.00  2.20  1.00
assign ( resid   66 and name HA   )   ( resid   87 and name HD*  )   4.00  2.20  2.00
assign ( resid   67 and name HN   )   ( resid   67 and name HB*  )   3.00  1.20  0.50
assign ( resid   67 and name HN   )   ( resid   87 and name HD*  )   4.00  2.20  2.00
assign ( resid   67 and name HA   )   ( resid   67 and name HG*  )   4.00  2.20  1.00
assign ( resid   67 and name HA   )   ( resid   87 and name HD*  )   4.00  2.20  1.00
assign ( resid   67 and name HB*  )   ( resid   68 and name HN   )   4.00  2.20  1.00
assign ( resid   67 and name HB*  )   ( resid   87 and name HD*  )   4.00  2.20  1.00
assign ( resid   67 and name HG*  )   ( resid   68 and name HN   )   3.00  1.20  0.50
assign ( resid   67 and name HG*  )   ( resid   75 and name HN   )   4.00  2.20  2.00
assign ( resid   67 and name HG*  )   ( resid   87 and name HD*  )   4.00  2.20  1.00
assign ( resid   68 and name HA1  )   ( resid   71 and name HD*  )   4.00  2.20  1.00
assign ( resid   69 and name HN   )   ( resid   71 and name HG*  )   4.00  2.20  1.00
assign ( resid   69 and name HN   )   ( resid   71 and name HD*  )   4.00  2.20  1.00
assign ( resid   70 and name HN   )   ( resid   71 and name HG*  )   4.00  2.20  1.00
assign ( resid   70 and name HN   )   ( resid   71 and name HD*  )   4.00  2.20  1.00
assign ( resid   70 and name HB1  )   ( resid   71 and name HD*  )   4.00  2.20  1.00
assign ( resid   71 and name HB*  )   ( resid   73 and name HG*  )   4.00  2.20  1.00
assign ( resid   71 and name HG*  )   ( resid   73 and name HG*  )   4.00  2.20  1.00
assign ( resid   71 and name HD*  )   ( resid   75 and name HZ2  )   4.00  2.20  2.00
assign ( resid   73 and name HN   )   ( resid   73 and name HB*  )   3.00  1.20  0.50
assign ( resid   73 and name HN   )   ( resid   73 and name HG*  )   3.00  1.20  0.50
assign ( resid   73 and name HN   )   ( resid   74 and name HA*  )   4.00  2.20  1.00
assign ( resid   73 and name HB*  )   ( resid   74 and name HN   )   4.00  2.20  1.00
assign ( resid   73 and name HB*  )   ( resid   75 and name HN   )   4.00  2.20  1.00
assign ( resid   73 and name HB*  )   ( resid   75 and name HD1  )   3.00  1.20  0.50
assign ( resid   73 and name HB*  )   ( resid   75 and name HE1  )   3.00  1.20  0.50
assign ( resid   73 and name HG*  )   ( resid   75 and name HE1  )   4.00  2.20  1.00
assign ( resid   74 and name HA*  )   ( resid   87 and name HN   )   4.00  2.20  2.00
assign ( resid   74 and name HA*  )   ( resid   87 and name HB*  )   4.00  2.20  1.00
assign ( resid   74 and name HA*  )   ( resid   88 and name HN   )   4.00  2.20  2.00
assign ( resid   74 and name HA*  )   ( resid   88 and name HA   )   4.00  2.20  1.00
assign ( resid   74 and name HA*  )   ( resid   91 and name HA   )   4.00  2.20  1.00
assign ( resid   74 and name HA*  )   ( resid   91 and name HB2  )   4.00  2.20  1.00
assign ( resid   74 and name HA*  )   ( resid   91 and name HB1  )   4.00  2.20  1.00
assign ( resid   74 and name HA*  )   ( resid   91 and name HE*  )   4.00  2.20  1.00
assign ( resid   75 and name HA   )   ( resid   87 and name HB*  )   4.00  2.20  1.00
assign ( resid   75 and name HA   )   ( resid   87 and name HD*  )   4.00  2.20  1.00
assign ( resid   76 and name HN   )   ( resid   87 and name HB*  )   4.00  2.20  1.00
assign ( resid   76 and name HN   )   ( resid   87 and name HD*  )   4.00  2.20  1.00
assign ( resid   76 and name HA2  )   ( resid   87 and name HD*  )   4.00  2.20  1.00
assign ( resid   76 and name HA1  )   ( resid   87 and name HD*  )   4.00  2.20  1.00
assign ( resid   77 and name HN   )   ( resid   87 and name HD*  )   4.00  2.20  1.00
assign ( resid   78 and name HB2  )   ( resid   81 and name HB*  )   4.00  2.20  1.00
assign ( resid   78 and name HB1  )   ( resid   81 and name HB*  )   3.00  1.20  0.50
assign ( resid   81 and name HN   )   ( resid   81 and name HB*  )   3.00  1.20  0.50
assign ( resid   81 and name HB*  )   ( resid   82 and name HN   )   4.00  2.20  1.00
assign ( resid   81 and name HB*  )   ( resid   83 and name HG2* )   3.00  1.20  0.50
assign ( resid   85 and name HN   )   ( resid   87 and name HD*  )   4.00  2.20  2.00
assign ( resid   85 and name HA   )   ( resid   86 and name HB*  )   4.00  2.20  1.00
assign ( resid   85 and name HD1  )   ( resid   87 and name HD*  )   4.00  2.20  1.00
assign ( resid   85 and name HE1  )   ( resid   87 and name HB*  )   4.00  2.20  2.00
assign ( resid   85 and name HE1  )   ( resid   87 and name HD*  )   3.00  1.20  0.50
assign ( resid   85 and name HZ   )   ( resid   87 and name HD*  )   4.00  2.20  1.00
assign ( resid   86 and name HN   )   ( resid   86 and name HB*  )   3.00  1.20  0.50
assign ( resid   86 and name HB*  )   ( resid   87 and name HN   )   4.00  2.20  1.00
assign ( resid   86 and name HB*  )   ( resid   88 and name HN   )   4.00  2.20  1.00
assign ( resid   87 and name HN   )   ( resid   87 and name HB*  )   3.00  1.20  0.50
assign ( resid   87 and name HN   )   ( resid   87 and name HD*  )   4.00  2.20  1.00
assign ( resid   87 and name HN   )   ( resid   88 and name HB*  )   4.00  2.20  1.00
assign ( resid   87 and name HA   )   ( resid   87 and name HD*  )   3.00  1.20  0.50
assign ( resid   87 and name HB*  )   ( resid   87 and name HD*  )   3.00  1.20  0.50
assign ( resid   87 and name HB*  )   ( resid   88 and name HN   )   4.00  2.20  1.00
assign ( resid   87 and name HB*  )   ( resid   89 and name HN   )   4.00  2.20  2.00
assign ( resid   87 and name HB*  )   ( resid   91 and name HA   )   4.00  2.20  2.00
assign ( resid   87 and name HD*  )   ( resid   88 and name HN   )   4.00  2.20  2.00
assign ( resid   87 and name HD*  )   ( resid   90 and name HN   )   4.00  2.20  1.00
assign ( resid   87 and name HD*  )   ( resid   90 and name HB2  )   3.00  1.20  0.50
assign ( resid   87 and name HD*  )   ( resid   90 and name HB1  )   4.00  2.20  1.00
assign ( resid   87 and name HD*  )   ( resid   90 and name HG2  )   4.00  2.20  1.00
assign ( resid   87 and name HD*  )   ( resid   90 and name HG1  )   4.00  2.20  1.00
assign ( resid   87 and name HD*  )   ( resid   90 and name HD*  )   3.00  1.20  0.50
assign ( resid   87 and name HD*  )   ( resid   91 and name HA   )   4.00  2.20  1.00
assign ( resid   88 and name HN   )   ( resid   88 and name HB*  )   3.00  1.20  0.50
assign ( resid   89 and name HN   )   ( resid   89 and name HB*  )   3.00  1.20  0.50
assign ( resid   89 and name HB*  )   ( resid   90 and name HN   )   3.00  1.20  0.50
assign ( resid   92 and name HA   )   ( resid   93 and name HG*  )   4.00  2.20  1.00
assign ( resid   92 and name HB   )   ( resid   93 and name HD*  )   4.00  2.20  2.00
assign ( resid   93 and name HB*  )   ( resid   94 and name HB*  )   4.00  2.20  2.00
assign ( resid   93 and name HG*  )   ( resid   94 and name HN   )   4.00  2.20  1.00
assign ( resid   93 and name HD*  )   ( resid   94 and name HN   )   4.00  2.20  1.00
assign ( resid   95 and name HN   )   ( resid   95 and name HB*  )   4.00  2.20  1.00
assign ( resid   95 and name HA   )   ( resid   95 and name HD2* )   4.00  2.20  1.00
assign ( resid   95 and name HB*  )   ( resid   95 and name HD2* )   3.00  1.20  0.50
assign ( resid   95 and name HB*  )   ( resid   96 and name HN   )   4.00  2.20  1.00
assign ( resid   96 and name HA*  )   ( resid   97 and name HG*  )   4.00  2.20  1.00
assign ( resid   97 and name HA   )   ( resid   98 and name HG1* )   4.00  2.20  1.00
assign ( resid   98 and name HN   )   ( resid   98 and name HG1* )   4.00  2.20  1.00
assign ( resid   98 and name HA   )   ( resid   99 and name HD*  )   3.00  1.20  0.50
assign ( resid   98 and name HB   )   ( resid   99 and name HD*  )   4.00  2.20  1.00
assign ( resid   98 and name HG2* )   ( resid   99 and name HB*  )   4.00  2.20  1.00
assign ( resid   98 and name HG2* )   ( resid   99 and name HD*  )   3.00  1.20  0.50
assign ( resid   98 and name HG1* )   ( resid   99 and name HD*  )   4.00  2.20  1.00
assign ( resid   99 and name HB*  )   ( resid  100 and name HN   )   4.00  2.20  1.00
assign ( resid   99 and name HB*  )   ( resid  101 and name HE1  )   4.00  2.20  1.00
assign ( resid   99 and name HB*  )   ( resid  101 and name HE2  )   4.00  2.20  1.00
assign ( resid   99 and name HG*  )   ( resid  101 and name HE2  )   4.00  2.20  2.00
assign ( resid  100 and name HN   )   ( resid  100 and name HB*  )   3.00  1.20  0.50
assign ( resid  100 and name HN   )   ( resid  100 and name HG*  )   4.00  2.20  1.00
assign ( resid  100 and name HA   )   ( resid  100 and name HG*  )   3.00  1.20  0.50
assign ( resid  100 and name HB*  )   ( resid  100 and name HD*  )   3.00  1.20  0.50
assign ( resid  100 and name HB*  )   ( resid  101 and name HA   )   4.00  2.20  2.00
assign ( resid  100 and name HG*  )   ( resid  101 and name HN   )   4.00  2.20  1.00
assign ( resid  100 and name HG*  )   ( resid  101 and name HA   )   4.00  2.20  2.00
assign ( resid  100 and name HG*  )   ( resid  102 and name HN   )   3.00  1.20  0.50
assign ( resid  100 and name HG*  )   ( resid  102 and name HG*  )   4.00  2.20  1.00
assign ( resid  100 and name HD*  )   ( resid  102 and name HG*  )   4.00  2.20  1.00
assign ( resid  101 and name HN   )   ( resid  101 and name HB*  )   3.00  1.20  0.50
assign ( resid  101 and name HN   )   ( resid  102 and name HG*  )   4.00  2.20  1.00
assign ( resid  101 and name HB*  )   ( resid  102 and name HG*  )   4.00  2.20  1.00
assign ( resid  102 and name HN   )   ( resid  102 and name HG*  )   3.00  1.20  0.50
assign ( resid  102 and name HA   )   ( resid  102 and name HG*  )   3.00  1.20  0.50
assign ( resid   21 and name HN   )   ( resid   31 and name HH2  )   4.00  2.20  2.00


constraints/rp1313_dihed.tbl0100600002045500006010000003307410502075507015541 0ustar  alemakoarrowassign ( resid    6 and name C    )   ( resid    7 and name N    ) 
        (resid    7 and name CA   )   ( resid    7 and name C    )  1  -66.80   14.30 2
assign ( resid    7 and name N    )   ( resid    7 and name CA   ) 
        (resid    7 and name C    )   ( resid    8 and name N    )  1  -37.65   10.95 2
assign ( resid    7 and name C    )   ( resid    8 and name N    ) 
        (resid    8 and name CA   )   ( resid    8 and name C    )  1  -63.10   10.00 2
assign ( resid    8 and name N    )   ( resid    8 and name CA   ) 
        (resid    8 and name C    )   ( resid    9 and name N    )  1  -43.65   12.65 2
assign ( resid    8 and name C    )   ( resid    9 and name N    ) 
        (resid    9 and name CA   )   ( resid    9 and name C    )  1  -73.70   18.60 2
assign ( resid    9 and name N    )   ( resid    9 and name CA   ) 
        (resid    9 and name C    )   ( resid   10 and name N    )  1  -23.10   33.00 2
assign ( resid   10 and name C    )   ( resid   11 and name N    ) 
        (resid   11 and name CA   )   ( resid   11 and name C    )  1  -79.20   20.60 2
assign ( resid   11 and name N    )   ( resid   11 and name CA   ) 
        (resid   11 and name C    )   ( resid   12 and name N    )  1  135.10   16.80 2
assign ( resid   11 and name C    )   ( resid   12 and name N    ) 
        (resid   12 and name CA   )   ( resid   12 and name C    )  1  -93.20   39.00 2
assign ( resid   12 and name N    )   ( resid   12 and name CA   ) 
        (resid   12 and name C    )   ( resid   13 and name N    )  1  143.65   49.45 2
assign ( resid   13 and name C    )   ( resid   14 and name N    ) 
        (resid   14 and name CA   )   ( resid   14 and name C    )  1 -122.60   41.20 2
assign ( resid   14 and name N    )   ( resid   14 and name CA   ) 
        (resid   14 and name C    )   ( resid   15 and name N    )  1  156.75   39.05 2
assign ( resid   14 and name C    )   ( resid   15 and name N    ) 
        (resid   15 and name CA   )   ( resid   15 and name C    )  1 -112.15   56.55 2
assign ( resid   15 and name N    )   ( resid   15 and name CA   ) 
        (resid   15 and name C    )   ( resid   16 and name N    )  1  116.95   57.45 2
assign ( resid   23 and name C    )   ( resid   24 and name N    ) 
        (resid   24 and name CA   )   ( resid   24 and name C    )  1  -62.45   11.85 2
assign ( resid   24 and name N    )   ( resid   24 and name CA   ) 
        (resid   24 and name C    )   ( resid   25 and name N    )  1  -43.95   13.65 2
assign ( resid   24 and name C    )   ( resid   25 and name N    ) 
        (resid   25 and name CA   )   ( resid   25 and name C    )  1  -63.55   16.65 2
assign ( resid   25 and name N    )   ( resid   25 and name CA   ) 
        (resid   25 and name C    )   ( resid   26 and name N    )  1  -38.85   22.55 2
assign ( resid   25 and name C    )   ( resid   26 and name N    ) 
        (resid   26 and name CA   )   ( resid   26 and name C    )  1  -67.85   17.95 2
assign ( resid   26 and name N    )   ( resid   26 and name CA   ) 
        (resid   26 and name C    )   ( resid   27 and name N    )  1  -33.25   22.55 2
assign ( resid   28 and name C    )   ( resid   29 and name N    ) 
        (resid   29 and name CA   )   ( resid   29 and name C    )  1 -106.15   44.95 2
assign ( resid   29 and name N    )   ( resid   29 and name CA   ) 
        (resid   29 and name C    )   ( resid   30 and name N    )  1  136.65   54.95 2
assign ( resid   33 and name C    )   ( resid   34 and name N    ) 
        (resid   34 and name CA   )   ( resid   34 and name C    )  1 -122.50   41.30 2
assign ( resid   34 and name N    )   ( resid   34 and name CA   ) 
        (resid   34 and name C    )   ( resid   35 and name N    )  1  146.95   27.45 2
assign ( resid   34 and name C    )   ( resid   35 and name N    ) 
        (resid   35 and name CA   )   ( resid   35 and name C    )  1 -125.90   37.20 2
assign ( resid   35 and name N    )   ( resid   35 and name CA   ) 
        (resid   35 and name C    )   ( resid   36 and name N    )  1  145.75   37.15 2
assign ( resid   35 and name C    )   ( resid   36 and name N    ) 
        (resid   36 and name CA   )   ( resid   36 and name C    )  1 -127.15   29.85 2
assign ( resid   36 and name N    )   ( resid   36 and name CA   ) 
        (resid   36 and name C    )   ( resid   37 and name N    )  1  133.15   23.65 2
assign ( resid   36 and name C    )   ( resid   37 and name N    ) 
        (resid   37 and name CA   )   ( resid   37 and name C    )  1  -87.35   37.75 2
assign ( resid   37 and name N    )   ( resid   37 and name CA   ) 
        (resid   37 and name C    )   ( resid   38 and name N    )  1  126.25   21.45 2
assign ( resid   41 and name C    )   ( resid   42 and name N    ) 
        (resid   42 and name CA   )   ( resid   42 and name C    )  1  -70.90   23.40 2
assign ( resid   42 and name N    )   ( resid   42 and name CA   ) 
        (resid   42 and name C    )   ( resid   43 and name N    )  1  124.85   17.95 2
assign ( resid   44 and name C    )   ( resid   45 and name N    ) 
        (resid   45 and name CA   )   ( resid   45 and name C    )  1 -109.40   35.90 2
assign ( resid   45 and name N    )   ( resid   45 and name CA   ) 
        (resid   45 and name C    )   ( resid   46 and name N    )  1  141.15   25.65 2
assign ( resid   45 and name C    )   ( resid   46 and name N    ) 
        (resid   46 and name CA   )   ( resid   46 and name C    )  1  -95.90   57.10 2
assign ( resid   46 and name N    )   ( resid   46 and name CA   ) 
        (resid   46 and name C    )   ( resid   47 and name N    )  1  166.40   28.10 2
assign ( resid   46 and name C    )   ( resid   47 and name N    ) 
        (resid   47 and name CA   )   ( resid   47 and name C    )  1  -78.50   32.70 2
assign ( resid   47 and name N    )   ( resid   47 and name CA   ) 
        (resid   47 and name C    )   ( resid   48 and name N    )  1   -9.65   31.75 2
assign ( resid   50 and name C    )   ( resid   51 and name N    ) 
        (resid   51 and name CA   )   ( resid   51 and name C    )  1  -76.80   32.10 2
assign ( resid   51 and name N    )   ( resid   51 and name CA   ) 
        (resid   51 and name C    )   ( resid   52 and name N    )  1  -31.40   52.80 2
assign ( resid   52 and name C    )   ( resid   53 and name N    ) 
        (resid   53 and name CA   )   ( resid   53 and name C    )  1  -64.05   14.75 2
assign ( resid   53 and name N    )   ( resid   53 and name CA   ) 
        (resid   53 and name C    )   ( resid   54 and name N    )  1  -37.70   20.20 2
assign ( resid   53 and name C    )   ( resid   54 and name N    ) 
        (resid   54 and name CA   )   ( resid   54 and name C    )  1  -65.30   10.00 2
assign ( resid   54 and name N    )   ( resid   54 and name CA   ) 
        (resid   54 and name C    )   ( resid   55 and name N    )  1  -35.45   11.05 2
assign ( resid   54 and name C    )   ( resid   55 and name N    ) 
        (resid   55 and name CA   )   ( resid   55 and name C    )  1  -64.50   15.00 2
assign ( resid   55 and name N    )   ( resid   55 and name CA   ) 
        (resid   55 and name C    )   ( resid   56 and name N    )  1  -43.35   10.05 2
assign ( resid   55 and name C    )   ( resid   56 and name N    ) 
        (resid   56 and name CA   )   ( resid   56 and name C    )  1  -64.95   11.35 2
assign ( resid   56 and name N    )   ( resid   56 and name CA   ) 
        (resid   56 and name C    )   ( resid   57 and name N    )  1  -38.65   15.85 2
assign ( resid   56 and name C    )   ( resid   57 and name N    ) 
        (resid   57 and name CA   )   ( resid   57 and name C    )  1  -64.50   18.80 2
assign ( resid   57 and name N    )   ( resid   57 and name CA   ) 
        (resid   57 and name C    )   ( resid   58 and name N    )  1  -36.85   14.05 2
assign ( resid   57 and name C    )   ( resid   58 and name N    ) 
        (resid   58 and name CA   )   ( resid   58 and name C    )  1  -66.30   10.00 2
assign ( resid   58 and name N    )   ( resid   58 and name CA   ) 
        (resid   58 and name C    )   ( resid   59 and name N    )  1  -42.90   10.00 2
assign ( resid   58 and name C    )   ( resid   59 and name N    ) 
        (resid   59 and name CA   )   ( resid   59 and name C    )  1  -61.20   10.00 2
assign ( resid   59 and name N    )   ( resid   59 and name CA   ) 
        (resid   59 and name C    )   ( resid   60 and name N    )  1  -42.25   14.65 2
assign ( resid   59 and name C    )   ( resid   60 and name N    ) 
        (resid   60 and name CA   )   ( resid   60 and name C    )  1  -74.10   24.60 2
assign ( resid   60 and name N    )   ( resid   60 and name CA   ) 
        (resid   60 and name C    )   ( resid   61 and name N    )  1  -26.80   31.30 2
assign ( resid   60 and name C    )   ( resid   61 and name N    ) 
        (resid   61 and name CA   )   ( resid   61 and name C    )  1 -110.85   31.45 2
assign ( resid   61 and name N    )   ( resid   61 and name CA   ) 
        (resid   61 and name C    )   ( resid   62 and name N    )  1   -5.85   35.85 2
assign ( resid   62 and name C    )   ( resid   63 and name N    ) 
        (resid   63 and name CA   )   ( resid   63 and name C    )  1 -116.35   42.15 2
assign ( resid   64 and name C    )   ( resid   65 and name N    ) 
        (resid   65 and name CA   )   ( resid   65 and name C    )  1 -117.80   26.30 2
assign ( resid   65 and name N    )   ( resid   65 and name CA   ) 
        (resid   65 and name C    )   ( resid   66 and name N    )  1  148.30   28.00 2
assign ( resid   65 and name C    )   ( resid   66 and name N    ) 
        (resid   66 and name CA   )   ( resid   66 and name C    )  1 -131.90   23.40 2
assign ( resid   66 and name N    )   ( resid   66 and name CA   ) 
        (resid   66 and name C    )   ( resid   67 and name N    )  1  151.80   26.60 2
assign ( resid   67 and name C    )   ( resid   68 and name N    ) 
        (resid   68 and name CA   )   ( resid   68 and name C    )  1  -80.95   67.15 2
assign ( resid   68 and name N    )   ( resid   68 and name CA   ) 
        (resid   68 and name C    )   ( resid   69 and name N    )  1  125.95   24.55 2
assign ( resid   74 and name C    )   ( resid   75 and name N    ) 
        (resid   75 and name CA   )   ( resid   75 and name C    )  1 -129.50   32.90 2
assign ( resid   75 and name N    )   ( resid   75 and name CA   ) 
        (resid   75 and name C    )   ( resid   76 and name N    )  1  157.20   21.40 2
assign ( resid   76 and name C    )   ( resid   77 and name N    ) 
        (resid   77 and name CA   )   ( resid   77 and name C    )  1 -123.00   33.70 2
assign ( resid   77 and name N    )   ( resid   77 and name CA   ) 
        (resid   77 and name C    )   ( resid   78 and name N    )  1  133.10   16.10 2
assign ( resid   77 and name C    )   ( resid   78 and name N    ) 
        (resid   78 and name CA   )   ( resid   78 and name C    )  1  -96.85   29.35 2
assign ( resid   78 and name N    )   ( resid   78 and name CA   ) 
        (resid   78 and name C    )   ( resid   79 and name N    )  1  133.10   48.50 2
assign ( resid   79 and name C    )   ( resid   80 and name N    ) 
        (resid   80 and name CA   )   ( resid   80 and name C    )  1  -75.20   40.10 2
assign ( resid   80 and name N    )   ( resid   80 and name CA   ) 
        (resid   80 and name C    )   ( resid   81 and name N    )  1  -37.25   15.35 2
assign ( resid   83 and name C    )   ( resid   84 and name N    ) 
        (resid   84 and name CA   )   ( resid   84 and name C    )  1 -115.25   30.95 2
assign ( resid   84 and name N    )   ( resid   84 and name CA   ) 
        (resid   84 and name C    )   ( resid   85 and name N    )  1  141.40   32.70 2
assign ( resid   84 and name C    )   ( resid   85 and name N    ) 
        (resid   85 and name CA   )   ( resid   85 and name C    )  1 -137.75   43.85 2
assign ( resid   85 and name N    )   ( resid   85 and name CA   ) 
        (resid   85 and name C    )   ( resid   86 and name N    )  1  154.90   29.40 2
assign ( resid   85 and name C    )   ( resid   86 and name N    ) 
        (resid   86 and name CA   )   ( resid   86 and name C    )  1  -85.05   47.75 2
assign ( resid   86 and name N    )   ( resid   86 and name CA   ) 
        (resid   86 and name C    )   ( resid   87 and name N    )  1  137.60   27.30 2
assign ( resid   87 and name C    )   ( resid   88 and name N    ) 
        (resid   88 and name CA   )   ( resid   88 and name C    )  1  -60.95   12.55 2
assign ( resid   88 and name N    )   ( resid   88 and name CA   ) 
        (resid   88 and name C    )   ( resid   89 and name N    )  1  -26.50   18.50 2
assign ( resid   88 and name C    )   ( resid   89 and name N    ) 
        (resid   89 and name CA   )   ( resid   89 and name C    )  1  -89.70   30.30 2
assign ( resid   89 and name N    )   ( resid   89 and name CA   ) 
        (resid   89 and name C    )   ( resid   90 and name N    )  1    0.65   21.35 2
assign ( resid   91 and name C    )   ( resid   92 and name N    ) 
        (resid   92 and name CA   )   ( resid   92 and name C    )  1  -99.95   59.85 2
assign ( resid   92 and name N    )   ( resid   92 and name CA   ) 
        (resid   92 and name C    )   ( resid   93 and name N    )  1  126.95   36.85 2
assign ( resid   97 and name C    )   ( resid   98 and name N    ) 
        (resid   98 and name CA   )   ( resid   98 and name C    )  1 -108.75   42.25 2
assign ( resid   98 and name N    )   ( resid   98 and name CA   ) 
        (resid   98 and name C    )   ( resid   99 and name N    )  1  134.45   40.55 2
assign ( resid   99 and name C    )   ( resid  100 and name N    ) 
        (resid  100 and name CA   )   ( resid  100 and name C    )  1 -118.15   52.15 2
assign ( resid  100 and name N    )   ( resid  100 and name CA   ) 
        (resid  100 and name C    )   ( resid  101 and name N    )  1  147.75   49.25 2
constraints/rp1313_hbond.tbl0100600002045500006010000000226410502075507015553 0ustar  alemakoarrowassign ( resid    5 and name O    )   ( resid    8 and name HN   )   2.00  0.20  0.30
assign ( resid    5 and name O    )   ( resid    8 and name N    )   3.00  0.30  0.30
assign ( resid    6 and name O    )   ( resid    9 and name HN   )   2.00  0.20  0.30
assign ( resid    6 and name O    )   ( resid    9 and name N    )   3.00  0.30  0.30
assign ( resid    7 and name O    )   ( resid   10 and name HN   )   2.00  0.20  0.30
assign ( resid    7 and name O    )   ( resid   10 and name N    )   3.00  0.30  0.30
assign ( resid   21 and name O    )   ( resid   25 and name HN   )   2.00  0.20  0.30
assign ( resid   21 and name O    )   ( resid   25 and name N    )   3.00  0.30  0.30
assign ( resid   23 and name O    )   ( resid   26 and name HN   )   2.00  0.20  0.30
assign ( resid   23 and name O    )   ( resid   26 and name N    )   3.00  0.30  0.30
assign ( resid   24 and name O    )   ( resid   27 and name HN   )   2.00  0.20  0.30
assign ( resid   24 and name O    )   ( resid   27 and name N    )   3.00  0.30  0.30
assign ( resid   24 and name O    )   ( resid   29 and name HN   )   2.00  0.20  0.30
assign ( resid   24 and name O    )   ( resid   29 and name N    )   3.00  0.30  0.30

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          HT1       MET   1  -0.933  -0.389  -0.354
    2   2H    MET   1          HT2       MET   1  -1.009  -0.240  -2.041
    3   3H    MET   1          HT3       MET   1  -0.930   1.149  -1.072
    4    HA   MET   1           HA       MET   1   1.195   0.783  -2.043
    5   1HB   MET   1          HB2       MET   1   1.053   1.578   0.317
    6   2HB   MET   1          HB1       MET   1   1.258  -0.086   0.846
    7   1HG   MET   1          HG2       MET   1   3.450  -0.172  -0.175
    8   2HG   MET   1          HG1       MET   1   3.243   1.464  -0.799
    9   1HE   MET   1          HE1       MET   1   5.964   1.997   1.923
   10   2HE   MET   1          HE2       MET   1   5.504   2.263   0.241
   11   3HE   MET   1          HE3       MET   1   5.789   0.625   0.830
   12    H    THR   2           HN       THR   2   0.349  -2.022  -0.009
   13    HA   THR   2           HA       THR   2   1.420  -3.800  -2.034
   14    HB   THR   2           HB       THR   2   2.512  -3.867   0.797
   15    HG1  THR   2           HG1      THR   2   4.095  -2.670   0.069
   16   1HG2  THR   2          HG21      THR   2   4.015  -5.606  -0.056
   17   2HG2  THR   2          HG22      THR   2   3.216  -5.529  -1.627
   18   3HG2  THR   2          HG23      THR   2   2.326  -6.089  -0.210
   19    H    MET   3           HN       MET   3   0.464  -5.841  -1.946
   20    HA   MET   3           HA       MET   3  -1.984  -6.138  -0.606
   21   1HB   MET   3          HB2       MET   3  -0.166  -8.291  -1.709
   22   2HB   MET   3          HB1       MET   3  -1.849  -8.520  -1.259
   23   1HG   MET   3          HG2       MET   3  -2.529  -6.933  -2.984
   24   2HG   MET   3          HG1       MET   3  -0.841  -6.703  -3.435
   25   1HE   MET   3          HE1       MET   3  -1.218  -7.297  -5.947
   26   2HE   MET   3          HE2       MET   3  -2.947  -7.425  -5.620
   27   3HE   MET   3          HE3       MET   3  -2.118  -8.708  -6.501
   28    H    GLY   4           HN       GLY   4  -2.399  -6.502   1.462
   29   1HA   GLY   4          HA2       GLY   4  -0.293  -7.050   3.315
   30   2HA   GLY   4          HA1       GLY   4  -2.001  -6.901   3.694
   31    H    CYS   5           HN       CYS   5   0.506  -8.938   3.879
   32    HA   CYS   5           HA       CYS   5  -0.553 -11.440   3.160
   33   1HB   CYS   5          HB2       CYS   5   1.131 -12.361   4.729
   34   2HB   CYS   5          HB1       CYS   5   1.812 -11.145   3.653
   35    H    ARG   6           HN       ARG   6  -1.126 -13.180   4.814
   36    HA   ARG   6           HA       ARG   6  -3.489 -12.555   6.087
   37   1HB   ARG   6          HB2       ARG   6  -3.451 -14.744   7.083
   38   2HB   ARG   6          HB1       ARG   6  -2.816 -14.842   5.451
   39   1HG   ARG   6          HG2       ARG   6  -1.057 -14.699   7.886
   40   2HG   ARG   6          HG1       ARG   6  -1.635 -16.215   7.200
   41   1HD   ARG   6          HD2       ARG   6   0.075 -14.150   5.819
   42   2HD   ARG   6          HD1       ARG   6   0.601 -15.727   6.404
   43    HE   ARG   6           HE       ARG   6  -1.464 -16.238   4.650
   44   1HH1  ARG   6          HH11      ARG   6   1.717 -14.759   4.511
   45   2HH1  ARG   6          HH12      ARG   6   1.929 -15.088   2.820
   46   1HH2  ARG   6          HH21      ARG   6  -1.171 -16.685   2.422
   47   2HH2  ARG   6          HH22      ARG   6   0.285 -16.155   1.629
   48    H    HIS   7           HN       HIS   7  -0.299 -12.104   7.326
   49    HA   HIS   7           HA       HIS   7  -0.825 -12.095  10.085
   50   1HB   HIS   7          HB2       HIS   7   1.218 -10.616   8.431
   51   2HB   HIS   7          HB1       HIS   7   1.154 -10.491  10.184
   52    HD2  HIS   7           HD2      HIS   7   1.179 -13.307  11.324
   53    HE1  HIS   7           HE1      HIS   7   4.062 -14.317   8.405
   54    HE2  HIS   7           HE2      HIS   7   2.899 -15.076  10.520
   55    H    VAL   8           HN       VAL   8  -1.486  -9.739   7.598
   56    HA   VAL   8           HA       VAL   8  -1.773  -7.464   9.280
   57    HB   VAL   8           HB       VAL   8  -3.150  -7.895   6.633
   58   1HG1  VAL   8          HG11      VAL   8  -2.248  -5.382   8.026
   59   2HG1  VAL   8          HG12      VAL   8  -3.913  -5.943   7.870
   60   3HG1  VAL   8          HG13      VAL   8  -3.006  -5.467   6.435
   61   1HG2  VAL   8          HG21      VAL   8  -1.188  -6.892   5.594
   62   2HG2  VAL   8          HG22      VAL   8  -0.816  -8.425   6.383
   63   3HG2  VAL   8          HG23      VAL   8  -0.368  -6.904   7.155
   64    H    ALA   9           HN       ALA   9  -3.835 -10.103   8.402
   65    HA   ALA   9           HA       ALA   9  -6.296  -8.856   8.942
   66   1HB   ALA   9          HB1       ALA   9  -6.134 -10.872   7.583
   67   2HB   ALA   9          HB2       ALA   9  -7.233 -11.116   8.940
   68   3HB   ALA   9          HB3       ALA   9  -5.604 -11.790   8.993
   69    H    GLY  10           HN       GLY  10  -3.819  -9.817  11.014
   70   1HA   GLY  10          HA2       GLY  10  -5.693 -10.135  13.272
   71   2HA   GLY  10          HA1       GLY  10  -4.102 -10.875  13.203
   72    H    ILE  11           HN       ILE  11  -3.950  -7.760  11.948
   73    HA   ILE  11           HA       ILE  11  -2.898  -6.789  14.511
   74    HB   ILE  11           HB       ILE  11  -1.725  -5.050  13.272
   75   1HG1  ILE  11          HG12      ILE  11  -2.797  -6.354  10.762
   76   2HG1  ILE  11          HG11      ILE  11  -3.388  -4.834  11.424
   77   1HG2  ILE  11          HG21      ILE  11  -0.111  -6.468  12.112
   78   2HG2  ILE  11          HG22      ILE  11  -1.272  -7.795  12.119
   79   3HG2  ILE  11          HG23      ILE  11  -0.623  -7.185  13.641
   80   1HD1  ILE  11          HD11      ILE  11  -0.591  -5.361  10.446
   81   2HD1  ILE  11          HD12      ILE  11  -1.187  -3.835  11.100
   82   3HD1  ILE  11          HD13      ILE  11  -1.843  -4.463   9.589
   83    H    ARG  12           HN       ARG  12  -3.483  -4.769  15.336
   84    HA   ARG  12           HA       ARG  12  -5.895  -3.562  14.162
   85   1HB   ARG  12          HB2       ARG  12  -6.880  -3.362  16.410
   86   2HB   ARG  12          HB1       ARG  12  -6.644  -5.044  15.948
   87   1HG   ARG  12          HG2       ARG  12  -5.115  -5.415  17.558
   88   2HG   ARG  12          HG1       ARG  12  -4.431  -3.793  17.435
   89   1HD   ARG  12          HD2       ARG  12  -5.495  -4.074  19.581
   90   2HD   ARG  12          HD1       ARG  12  -6.388  -2.901  18.618
   91    HE   ARG  12           HE       ARG  12  -7.774  -5.103  18.100
   92   1HH1  ARG  12          HH11      ARG  12  -6.549  -3.803  21.101
   93   2HH1  ARG  12          HH12      ARG  12  -7.755  -4.575  22.088
   94   1HH2  ARG  12          HH21      ARG  12  -9.409  -6.086  19.374
   95   2HH2  ARG  12          HH22      ARG  12  -9.398  -5.859  21.094
   96    H    THR  13           HN       THR  13  -6.421  -1.525  15.705
   97    HA   THR  13           HA       THR  13  -4.029   0.123  15.723
   98    HB   THR  13           HB       THR  13  -6.874   0.840  16.476
   99    HG1  THR  13           HG1      THR  13  -7.200   1.178  14.390
  100   1HG2  THR  13          HG21      THR  13  -6.133   3.155  16.124
  101   2HG2  THR  13          HG22      THR  13  -4.492   2.584  15.820
  102   3HG2  THR  13          HG23      THR  13  -5.216   2.379  17.415
  103    H    VAL  14           HN       VAL  14  -2.816   0.453  17.462
  104    HA   VAL  14           HA       VAL  14  -3.836  -0.534  20.042
  105    HB   VAL  14           HB       VAL  14  -1.496  -1.148  20.579
  106   1HG1  VAL  14          HG11      VAL  14  -3.020  -2.834  19.720
  107   2HG1  VAL  14          HG12      VAL  14  -1.390  -3.119  19.111
  108   3HG1  VAL  14          HG13      VAL  14  -2.608  -2.391  18.064
  109   1HG2  VAL  14          HG21      VAL  14  -0.972  -0.451  17.687
  110   2HG2  VAL  14          HG22      VAL  14   0.167  -1.241  18.779
  111   3HG2  VAL  14          HG23      VAL  14  -0.352   0.415  19.093
  112    H    THR  15           HN       THR  15  -2.037   0.253  21.789
  113    HA   THR  15           HA       THR  15  -1.725   3.160  21.422
  114    HB   THR  15           HB       THR  15  -2.367   1.757  24.025
  115    HG1  THR  15           HG1      THR  15  -3.970   2.327  22.005
  116   1HG2  THR  15          HG21      THR  15  -1.119   3.857  24.293
  117   2HG2  THR  15          HG22      THR  15  -2.777   4.020  24.870
  118   3HG2  THR  15          HG23      THR  15  -2.318   4.695  23.307
  119    HA   PRO  16           HA       PRO  16   2.583   2.201  22.060
  120   1HB   PRO  16          HB2       PRO  16   2.793   5.096  22.618
  121   2HB   PRO  16          HB1       PRO  16   3.607   4.126  21.386
  122   1HG   PRO  16          HG2       PRO  16   1.658   5.826  20.730
  123   2HG   PRO  16          HG1       PRO  16   1.825   4.260  19.914
  124   1HD   PRO  16          HD2       PRO  16  -0.081   5.078  22.075
  125   2HD   PRO  16          HD1       PRO  16  -0.378   4.099  20.621
  126    H    SER  17           HN       SER  17   3.987   1.965  23.764
  127    HA   SER  17           HA       SER  17   2.824   2.210  26.382
  128   1HB   SER  17          HB2       SER  17   4.203   0.243  25.602
  129   2HB   SER  17          HB1       SER  17   5.619   1.292  25.683
  130    HG   SER  17           HG       SER  17   5.531   0.281  27.627
  131    H    ALA  18           HN       ALA  18   5.248   3.885  24.496
  132    HA   ALA  18           HA       ALA  18   5.415   5.905  26.611
  133   1HB   ALA  18          HB1       ALA  18   7.839   6.079  26.363
  134   2HB   ALA  18          HB2       ALA  18   7.823   4.728  25.228
  135   3HB   ALA  18          HB3       ALA  18   7.367   4.470  26.912
  136    H    LEU  19           HN       LEU  19   7.135   7.655  25.496
  137    HA   LEU  19           HA       LEU  19   5.660   8.596  23.161
  138   1HB   LEU  19          HB2       LEU  19   7.886   9.951  24.681
  139   2HB   LEU  19          HB1       LEU  19   6.785  10.698  23.540
  140    HG   LEU  19           HG       LEU  19   5.923   9.505  26.172
  141   1HD1  LEU  19          HD11      LEU  19   5.773  11.813  26.954
  142   2HD1  LEU  19          HD12      LEU  19   6.474  12.371  25.433
  143   3HD1  LEU  19          HD13      LEU  19   7.428  11.373  26.530
  144   1HD2  LEU  19          HD21      LEU  19   3.867  10.764  25.764
  145   2HD2  LEU  19          HD22      LEU  19   4.167   9.597  24.475
  146   3HD2  LEU  19          HD23      LEU  19   4.504  11.308  24.212
  147    H    GLY  20           HN       GLY  20   7.998   6.519  23.510
  148   1HA   GLY  20          HA2       GLY  20   9.028   6.694  20.911
  149   2HA   GLY  20          HA1       GLY  20  10.199   7.392  22.026
  150    H    CYS  21           HN       CYS  21  11.646   5.659  21.475
  151    HA   CYS  21           HA       CYS  21  10.965   2.945  21.980
  152   1HB   CYS  21          HB2       CYS  21  12.809   3.615  20.469
  153   2HB   CYS  21          HB1       CYS  21  13.703   4.229  21.855
  154    HG   CYS  21           HG       CYS  21  15.042   2.025  21.863
  155    H    GLU  22           HN       GLU  22  10.399   2.279  23.915
  156    HA   GLU  22           HA       GLU  22  10.816   3.616  26.312
  157   1HB   GLU  22          HB2       GLU  22  10.320   0.651  25.968
  158   2HB   GLU  22          HB1       GLU  22   9.989   1.602  27.407
  159   1HG   GLU  22          HG2       GLU  22   7.899   1.492  26.523
  160   2HG   GLU  22          HG1       GLU  22   8.467   2.970  25.755
  161    H    GLU  23           HN       GLU  23  12.673   1.012  24.838
  162    HA   GLU  23           HA       GLU  23  14.332   0.471  27.051
  163   1HB   GLU  23          HB2       GLU  23  13.979  -0.599  24.528
  164   2HB   GLU  23          HB1       GLU  23  15.603   0.069  24.453
  165   1HG   GLU  23          HG2       GLU  23  15.723  -2.224  25.128
  166   2HG   GLU  23          HG1       GLU  23  16.184  -1.200  26.487
  167    H    CYS  24           HN       CYS  24  14.729   2.655  24.277
  168    HA   CYS  24           HA       CYS  24  17.340   3.499  24.997
  169   1HB   CYS  24          HB2       CYS  24  15.263   4.917  23.316
  170   2HB   CYS  24          HB1       CYS  24  16.977   5.320  23.386
  171    HG   CYS  24           HG       CYS  24  17.631   3.804  21.433
  172    H    LEU  25           HN       LEU  25  14.116   4.551  25.846
  173    HA   LEU  25           HA       LEU  25  14.837   7.003  27.063
  174   1HB   LEU  25          HB2       LEU  25  12.446   5.214  27.490
  175   2HB   LEU  25          HB1       LEU  25  12.611   6.818  28.179
  176    HG   LEU  25           HG       LEU  25  12.550   6.212  25.221
  177   1HD1  LEU  25          HD11      LEU  25  10.398   5.771  26.281
  178   2HD1  LEU  25          HD12      LEU  25  10.324   7.211  25.265
  179   3HD1  LEU  25          HD13      LEU  25  10.426   7.372  27.019
  180   1HD2  LEU  25          HD21      LEU  25  13.841   8.208  25.771
  181   2HD2  LEU  25          HD22      LEU  25  12.489   8.830  26.717
  182   3HD2  LEU  25          HD23      LEU  25  12.326   8.632  24.972
  183    H    LYS  26           HN       LYS  26  15.060   3.712  28.118
  184    HA   LYS  26           HA       LYS  26  14.923   4.219  30.921
  185   1HB   LYS  26          HB2       LYS  26  15.264   1.963  31.209
  186   2HB   LYS  26          HB1       LYS  26  14.678   1.971  29.553
  187   1HG   LYS  26          HG2       LYS  26  17.153   2.064  28.884
  188   2HG   LYS  26          HG1       LYS  26  17.478   1.594  30.553
  189   1HD   LYS  26          HD2       LYS  26  15.790   0.071  28.568
  190   2HD   LYS  26          HD1       LYS  26  17.422  -0.352  29.088
  191   1HE   LYS  26          HE2       LYS  26  16.640  -0.696  31.356
  192   2HE   LYS  26          HE1       LYS  26  15.015  -0.186  30.894
  193   1HZ   LYS  26          HZ1       LYS  26  16.453  -2.578  29.878
  194   2HZ   LYS  26          HZ2       LYS  26  14.921  -2.070  29.357
  195   3HZ   LYS  26          HZ3       LYS  26  15.150  -2.579  30.961
  196    H    ILE  27           HN       ILE  27  17.365   4.604  28.547
  197    HA   ILE  27           HA       ILE  27  19.353   5.072  30.673
  198    HB   ILE  27           HB       ILE  27  21.106   4.604  28.952
  199   1HG1  ILE  27          HG12      ILE  27  18.742   3.575  27.364
  200   2HG1  ILE  27          HG11      ILE  27  19.770   4.935  26.936
  201   1HG2  ILE  27          HG21      ILE  27  20.925   2.175  29.114
  202   2HG2  ILE  27          HG22      ILE  27  19.230   2.329  29.575
  203   3HG2  ILE  27          HG23      ILE  27  20.493   2.953  30.637
  204   1HD1  ILE  27          HD11      ILE  27  21.663   3.437  26.664
  205   2HD1  ILE  27          HD12      ILE  27  20.311   2.947  25.643
  206   3HD1  ILE  27          HD13      ILE  27  20.656   2.068  27.132
  207    H    GLY  28           HN       GLY  28  17.320   6.678  28.853
  208   1HA   GLY  28          HA2       GLY  28  17.199   8.820  28.043
  209   2HA   GLY  28          HA1       GLY  28  18.616   9.149  29.029
  210    H    SER  29           HN       SER  29  18.209   7.011  26.229
  211    HA   SER  29           HA       SER  29  20.375   8.516  24.927
  212   1HB   SER  29          HB2       SER  29  19.688   5.576  24.759
  213   2HB   SER  29          HB1       SER  29  20.906   6.368  23.762
  214    HG   SER  29           HG       SER  29  21.046   6.714  26.531
  215    HA   PRO  30           HA       PRO  30  17.590   9.485  21.682
  216   1HB   PRO  30          HB2       PRO  30  19.341   9.978  19.684
  217   2HB   PRO  30          HB1       PRO  30  19.155  11.058  21.070
  218   1HG   PRO  30          HG2       PRO  30  21.237   8.970  20.562
  219   2HG   PRO  30          HG1       PRO  30  21.432  10.612  21.203
  220   1HD   PRO  30          HD2       PRO  30  21.384   8.405  22.785
  221   2HD   PRO  30          HD1       PRO  30  20.803   9.992  23.325
  222    H    TRP  31           HN       TRP  31  16.967   8.887  19.477
  223    HA   TRP  31           HA       TRP  31  17.937   6.265  18.599
  224   1HB   TRP  31          HB2       TRP  31  15.596   5.593  18.085
  225   2HB   TRP  31          HB1       TRP  31  15.880   5.806  19.808
  226    HD1  TRP  31           HD1      TRP  31  14.280   7.742  16.846
  227    HE1  TRP  31           HE1      TRP  31  12.388   9.212  17.789
  228    HE3  TRP  31           HE3      TRP  31  14.910   6.772  21.827
  229    HZ2  TRP  31           HZ2      TRP  31  11.304   9.864  20.314
  230    HZ3  TRP  31           HZ3      TRP  31  13.402   7.856  23.439
  231    HH2  TRP  31           HH2      TRP  31  11.637   9.369  22.698
  232    H    VAL  32           HN       VAL  32  17.229   5.808  16.318
  233    HA   VAL  32           HA       VAL  32  17.445   8.244  14.744
  234    HB   VAL  32           HB       VAL  32  17.414   5.376  13.780
  235   1HG1  VAL  32          HG11      VAL  32  16.801   6.979  12.054
  236   2HG1  VAL  32          HG12      VAL  32  18.399   6.305  11.737
  237   3HG1  VAL  32          HG13      VAL  32  18.244   7.929  12.407
  238   1HG2  VAL  32          HG21      VAL  32  19.848   5.594  13.600
  239   2HG2  VAL  32          HG22      VAL  32  19.307   5.774  15.269
  240   3HG2  VAL  32          HG23      VAL  32  19.757   7.197  14.330
  241    H    HIS  33           HN       HIS  33  15.437   5.290  14.484
  242    HA   HIS  33           HA       HIS  33  13.076   6.980  14.221
  243   1HB   HIS  33          HB2       HIS  33  13.865   4.907  12.161
  244   2HB   HIS  33          HB1       HIS  33  12.257   5.616  12.276
  245    HD1  HIS  33           HD1      HIS  33  12.372   8.428  12.174
  246    HD2  HIS  33           HD2      HIS  33  15.457   6.235  10.434
  247    HE1  HIS  33           HE1      HIS  33  13.505   9.995  10.567
  248    HE2  HIS  33           HE2      HIS  33  15.491   8.712   9.691
  249    H    LEU  34           HN       LEU  34  11.041   5.577  14.258
  250    HA   LEU  34           HA       LEU  34  11.499   3.477  16.270
  251   1HB   LEU  34          HB2       LEU  34   9.323   5.562  16.207
  252   2HB   LEU  34          HB1       LEU  34   9.424   4.251  17.366
  253    HG   LEU  34           HG       LEU  34  11.462   6.458  17.070
  254   1HD1  LEU  34          HD11      LEU  34   9.328   6.015  19.152
  255   2HD1  LEU  34          HD12      LEU  34   9.341   7.288  17.931
  256   3HD1  LEU  34          HD13      LEU  34  10.570   7.267  19.197
  257   1HD2  LEU  34          HD21      LEU  34  12.431   4.371  17.874
  258   2HD2  LEU  34          HD22      LEU  34  11.185   4.260  19.117
  259   3HD2  LEU  34          HD23      LEU  34  12.363   5.571  19.165
  260    H    ARG  35           HN       ARG  35  10.357   1.668  16.162
  261    HA   ARG  35           HA       ARG  35   8.188   1.457  14.179
  262   1HB   ARG  35          HB2       ARG  35  10.229  -0.648  14.934
  263   2HB   ARG  35          HB1       ARG  35   8.876  -0.893  13.839
  264   1HG   ARG  35          HG2       ARG  35   9.818   0.718  12.282
  265   2HG   ARG  35          HG1       ARG  35  11.160   1.019  13.392
  266   1HD   ARG  35          HD2       ARG  35  11.884  -1.285  13.186
  267   2HD   ARG  35          HD1       ARG  35  10.501  -1.653  12.158
  268    HE   ARG  35           HE       ARG  35  11.963   0.451  10.997
  269   1HH1  ARG  35          HH11      ARG  35  12.207  -2.985  11.649
  270   2HH1  ARG  35          HH12      ARG  35  13.287  -3.294  10.316
  271   1HH2  ARG  35          HH21      ARG  35  13.406   0.052   9.254
  272   2HH2  ARG  35          HH22      ARG  35  13.981  -1.564   8.972
  273    H    ILE  36           HN       ILE  36   6.307   1.022  15.128
  274    HA   ILE  36           HA       ILE  36   6.332  -0.282  17.775
  275    HB   ILE  36           HB       ILE  36   5.421   1.973  17.863
  276   1HG1  ILE  36          HG12      ILE  36   3.251  -0.126  18.069
  277   2HG1  ILE  36          HG11      ILE  36   4.406   0.295  19.328
  278   1HG2  ILE  36          HG21      ILE  36   3.402   2.600  16.625
  279   2HG2  ILE  36          HG22      ILE  36   3.445   1.052  15.782
  280   3HG2  ILE  36          HG23      ILE  36   4.744   2.220  15.545
  281   1HD1  ILE  36          HD11      ILE  36   2.292   2.112  18.196
  282   2HD1  ILE  36          HD12      ILE  36   3.444   2.529  19.466
  283   3HD1  ILE  36          HD13      ILE  36   2.230   1.282  19.750
  284    H    CYS  37           HN       CYS  37   5.146  -2.144  18.070
  285    HA   CYS  37           HA       CYS  37   4.292  -3.622  15.802
  286   1HB   CYS  37          HB2       CYS  37   3.484  -4.032  18.680
  287   2HB   CYS  37          HB1       CYS  37   3.266  -5.186  17.379
  288    H    ARG  38           HN       ARG  38   2.246  -4.051  15.015
  289    HA   ARG  38           HA       ARG  38   0.093  -2.274  15.827
  290   1HB   ARG  38          HB2       ARG  38   0.236  -4.437  13.715
  291   2HB   ARG  38          HB1       ARG  38  -1.158  -3.402  13.986
  292   1HG   ARG  38          HG2       ARG  38   1.583  -2.499  13.122
  293   2HG   ARG  38          HG1       ARG  38   0.148  -2.617  12.103
  294   1HD   ARG  38          HD2       ARG  38   0.618  -0.751  14.419
  295   2HD   ARG  38          HD1       ARG  38   0.399  -0.329  12.721
  296    HE   ARG  38           HE       ARG  38  -1.787  -1.656  14.156
  297   1HH1  ARG  38          HH11      ARG  38  -0.523   1.196  12.550
  298   2HH1  ARG  38          HH12      ARG  38  -2.060   1.994  12.530
  299   1HH2  ARG  38          HH21      ARG  38  -3.793  -0.590  14.106
  300   2HH2  ARG  38          HH22      ARG  38  -3.907   1.000  13.411
  301    H    THR  39           HN       THR  39   1.183  -4.366  17.614
  302    HA   THR  39           HA       THR  39  -1.248  -5.952  18.065
  303    HB   THR  39           HB       THR  39   1.469  -7.068  18.686
  304    HG1  THR  39           HG1      THR  39   0.184  -7.742  16.267
  305   1HG2  THR  39          HG21      THR  39  -1.185  -8.332  17.992
  306   2HG2  THR  39          HG22      THR  39  -0.500  -8.186  19.611
  307   3HG2  THR  39          HG23      THR  39   0.293  -9.201  18.406
  308    H    CYS  40           HN       CYS  40   1.882  -5.597  19.771
  309    HA   CYS  40           HA       CYS  40   0.458  -5.504  22.285
  310   1HB   CYS  40          HB2       CYS  40   2.566  -5.817  23.356
  311   2HB   CYS  40          HB1       CYS  40   2.574  -6.842  21.927
  312    H    GLY  41           HN       GLY  41   1.725  -3.212  20.102
  313   1HA   GLY  41          HA2       GLY  41   1.590  -0.910  20.189
  314   2HA   GLY  41          HA1       GLY  41   0.914  -1.058  21.801
  315    H    HIS  42           HN       HIS  42   3.873  -2.692  21.435
  316    HA   HIS  42           HA       HIS  42   5.186  -0.677  23.069
  317   1HB   HIS  42          HB2       HIS  42   5.223  -3.282  23.417
  318   2HB   HIS  42          HB1       HIS  42   6.498  -3.232  22.207
  319    HD1  HIS  42           HD1      HIS  42   5.687  -2.057  25.679
  320    HD2  HIS  42           HD2      HIS  42   8.963  -2.365  23.136
  321    HE1  HIS  42           HE1      HIS  42   7.705  -1.596  27.113
  322    HE2  HIS  42           HE2      HIS  42   9.674  -1.709  25.543
  323    H    VAL  43           HN       VAL  43   7.055   0.395  22.475
  324    HA   VAL  43           HA       VAL  43   7.352   0.627  19.566
  325    HB   VAL  43           HB       VAL  43   8.509   2.504  21.624
  326   1HG1  VAL  43          HG11      VAL  43   8.314   4.155  19.837
  327   2HG1  VAL  43          HG12      VAL  43   7.625   2.929  18.774
  328   3HG1  VAL  43          HG13      VAL  43   9.291   2.777  19.330
  329   1HG2  VAL  43          HG21      VAL  43   5.738   2.655  20.443
  330   2HG2  VAL  43          HG22      VAL  43   6.490   3.850  21.500
  331   3HG2  VAL  43          HG23      VAL  43   6.120   2.238  22.113
  332    H    GLY  44           HN       GLY  44   9.588   1.079  18.752
  333   1HA   GLY  44          HA2       GLY  44  11.857   0.470  20.359
  334   2HA   GLY  44          HA1       GLY  44  11.437  -0.880  19.311
  335    H    CYS  45           HN       CYS  45  13.789   0.956  19.323
  336    HA   CYS  45           HA       CYS  45  13.567   2.536  16.962
  337   1HB   CYS  45          HB2       CYS  45  16.118   2.540  17.131
  338   2HB   CYS  45          HB1       CYS  45  15.230   3.232  18.484
  339    HG   CYS  45           HG       CYS  45  17.090   1.970  19.869
  340    H    CYS  46           HN       CYS  46  14.384   2.129  14.920
  341    HA   CYS  46           HA       CYS  46  13.897  -0.469  13.946
  342   1HB   CYS  46          HB2       CYS  46  14.787   0.496  11.787
  343   2HB   CYS  46          HB1       CYS  46  13.462   1.391  12.523
  344    HG   CYS  46           HG       CYS  46  15.614   2.988  11.314
  345    H    ASP  47           HN       ASP  47  15.487  -1.600  12.435
  346    HA   ASP  47           HA       ASP  47  17.801  -2.344  13.935
  347   1HB   ASP  47          HB2       ASP  47  18.258  -3.902  12.138
  348   2HB   ASP  47          HB1       ASP  47  16.536  -3.933  12.497
  349    H    ASP  48           HN       ASP  48  17.120   0.016  11.579
  350    HA   ASP  48           HA       ASP  48  19.707   0.486  10.556
  351   1HB   ASP  48          HB2       ASP  48  17.656   1.453   9.570
  352   2HB   ASP  48          HB1       ASP  48  17.443   2.452  11.004
  353    H    SER  49           HN       SER  49  18.139   1.242  13.553
  354    HA   SER  49           HA       SER  49  20.263   2.985  14.475
  355   1HB   SER  49          HB2       SER  49  18.018   1.711  16.066
  356   2HB   SER  49          HB1       SER  49  19.005   3.092  16.545
  357    HG   SER  49           HG       SER  49  17.770   3.436  14.128
  358    HA   PRO  50           HA       PRO  50  22.927  -0.294  15.767
  359   1HB   PRO  50          HB2       PRO  50  24.160   0.938  17.894
  360   2HB   PRO  50          HB1       PRO  50  24.586   1.204  16.202
  361   1HG   PRO  50          HG2       PRO  50  22.873   2.857  18.007
  362   2HG   PRO  50          HG1       PRO  50  24.070   3.379  16.807
  363   1HD   PRO  50          HD2       PRO  50  21.426   3.468  16.311
  364   2HD   PRO  50          HD1       PRO  50  22.607   3.092  15.039
  365    H    HIS  51           HN       HIS  51  20.632   1.118  17.939
  366    HA   HIS  51           HA       HIS  51  21.099  -0.668  20.129
  367   1HB   HIS  51          HB2       HIS  51  19.949   1.695  20.074
  368   2HB   HIS  51          HB1       HIS  51  18.500   0.768  19.719
  369    HD1  HIS  51           HD1      HIS  51  20.175   2.209  22.462
  370    HD2  HIS  51           HD2      HIS  51  18.252  -1.429  21.853
  371    HE1  HIS  51           HE1      HIS  51  19.564   1.371  24.753
  372    HE2  HIS  51           HE2      HIS  51  18.637  -0.942  24.368
  373    H    LYS  52           HN       LYS  52  18.939  -0.567  17.361
  374    HA   LYS  52           HA       LYS  52  17.463  -2.046  16.461
  375   1HB   LYS  52          HB2       LYS  52  19.461  -3.989  17.620
  376   2HB   LYS  52          HB1       LYS  52  18.224  -4.410  16.449
  377   1HG   LYS  52          HG2       LYS  52  19.244  -2.816  14.860
  378   2HG   LYS  52          HG1       LYS  52  20.533  -2.528  16.032
  379   1HD   LYS  52          HD2       LYS  52  21.186  -4.850  15.945
  380   2HD   LYS  52          HD1       LYS  52  19.824  -5.225  14.889
  381   1HE   LYS  52          HE2       LYS  52  20.777  -3.723  13.180
  382   2HE   LYS  52          HE1       LYS  52  22.167  -3.446  14.231
  383   1HZ   LYS  52          HZ1       LYS  52  22.809  -5.702  14.053
  384   2HZ   LYS  52          HZ2       LYS  52  22.475  -5.181  12.470
  385   3HZ   LYS  52          HZ3       LYS  52  21.352  -6.141  13.304
  386    H    HIS  53           HN       HIS  53  16.138  -1.213  18.544
  387    HA   HIS  53           HA       HIS  53  15.610  -3.305  20.444
  388   1HB   HIS  53          HB2       HIS  53  15.370  -0.853  20.972
  389   2HB   HIS  53          HB1       HIS  53  13.923  -0.844  19.965
  390    HD1  HIS  53           HD1      HIS  53  11.932  -0.840  21.482
  391    HD2  HIS  53           HD2      HIS  53  14.971  -3.299  22.896
  392    HE1  HIS  53           HE1      HIS  53  11.037  -1.880  23.578
  393    HE2  HIS  53           HE2      HIS  53  12.983  -3.162  24.542
  394    H    ALA  54           HN       ALA  54  14.116  -2.130  17.497
  395    HA   ALA  54           HA       ALA  54  11.629  -3.435  17.831
  396   1HB   ALA  54          HB1       ALA  54  12.976  -2.556  15.282
  397   2HB   ALA  54          HB2       ALA  54  11.939  -1.559  16.302
  398   3HB   ALA  54          HB3       ALA  54  11.271  -2.963  15.469
  399    H    THR  55           HN       THR  55  14.672  -4.456  16.364
  400    HA   THR  55           HA       THR  55  13.553  -6.789  15.147
  401    HB   THR  55           HB       THR  55  16.007  -7.417  14.860
  402    HG1  THR  55           HG1      THR  55  17.448  -6.190  15.795
  403   1HG2  THR  55          HG21      THR  55  14.706  -6.339  13.095
  404   2HG2  THR  55          HG22      THR  55  16.360  -5.727  13.118
  405   3HG2  THR  55          HG23      THR  55  15.053  -4.757  13.795
  406    H    ARG  56           HN       ARG  56  15.600  -6.220  18.010
  407    HA   ARG  56           HA       ARG  56  15.735  -8.921  18.803
  408   1HB   ARG  56          HB2       ARG  56  15.979  -6.386  20.427
  409   2HB   ARG  56          HB1       ARG  56  16.298  -7.992  21.068
  410   1HG   ARG  56          HG2       ARG  56  18.046  -8.276  19.325
  411   2HG   ARG  56          HG1       ARG  56  17.782  -6.595  18.854
  412   1HD   ARG  56          HD2       ARG  56  18.376  -5.871  21.115
  413   2HD   ARG  56          HD1       ARG  56  18.638  -7.551  21.585
  414    HE   ARG  56           HE       ARG  56  20.207  -6.494  19.359
  415   1HH1  ARG  56          HH11      ARG  56  20.070  -7.513  22.710
  416   2HH1  ARG  56          HH12      ARG  56  21.797  -7.586  22.889
  417   1HH2  ARG  56          HH21      ARG  56  22.464  -6.613  19.576
  418   2HH2  ARG  56          HH22      ARG  56  23.160  -7.120  21.091
  419    H    HIS  57           HN       HIS  57  13.443  -6.345  19.531
  420    HA   HIS  57           HA       HIS  57  11.892  -7.754  21.410
  421   1HB   HIS  57          HB2       HIS  57  11.628  -5.372  21.213
  422   2HB   HIS  57          HB1       HIS  57  11.180  -5.506  19.517
  423    HD1  HIS  57           HD1      HIS  57   9.752  -5.616  22.947
  424    HD2  HIS  57           HD2      HIS  57   8.586  -6.516  19.057
  425    HE1  HIS  57           HE1      HIS  57   7.227  -5.869  22.989
  426    H    PHE  58           HN       PHE  58  11.693  -7.524  17.873
  427    HA   PHE  58           HA       PHE  58   9.347  -8.976  17.488
  428   1HB   PHE  58          HB2       PHE  58  10.195  -7.915  15.578
  429   2HB   PHE  58          HB1       PHE  58  11.803  -8.594  15.799
  430    HD1  PHE  58           HD1      PHE  58   8.359 -10.040  15.488
  431    HD2  PHE  58           HD2      PHE  58  12.375 -10.007  14.116
  432    HE1  PHE  58           HE1      PHE  58   7.833 -11.855  13.914
  433    HE2  PHE  58           HE2      PHE  58  11.865 -11.822  12.539
  434    HZ   PHE  58           HZ       PHE  58   9.588 -12.751  12.438
  435    H    HIS  59           HN       HIS  59  12.694 -10.151  17.699
  436    HA   HIS  59           HA       HIS  59  12.038 -12.880  17.339
  437   1HB   HIS  59          HB2       HIS  59  14.295 -12.078  16.952
  438   2HB   HIS  59          HB1       HIS  59  14.442 -11.574  18.631
  439    HD1  HIS  59           HD1      HIS  59  15.566 -13.183  20.123
  440    HD2  HIS  59           HD2      HIS  59  13.985 -15.041  16.754
  441    HE1  HIS  59           HE1      HIS  59  16.300 -15.586  20.264
  442    HE2  HIS  59           HE2      HIS  59  15.181 -16.725  18.316
  443    H    ALA  60           HN       ALA  60  12.068 -10.792  20.127
  444    HA   ALA  60           HA       ALA  60  12.102 -12.908  22.059
  445   1HB   ALA  60          HB1       ALA  60  13.025 -10.688  22.538
  446   2HB   ALA  60          HB2       ALA  60  11.784 -11.155  23.701
  447   3HB   ALA  60          HB3       ALA  60  11.405 -10.000  22.423
  448    H    THR  61           HN       THR  61   9.594 -10.943  20.543
  449    HA   THR  61           HA       THR  61   7.602 -12.208  22.298
  450    HB   THR  61           HB       THR  61   6.091 -10.344  21.544
  451    HG1  THR  61           HG1      THR  61   8.540  -9.270  20.529
  452   1HG2  THR  61          HG21      THR  61   8.652  -9.542  22.932
  453   2HG2  THR  61          HG22      THR  61   7.251 -10.287  23.701
  454   3HG2  THR  61          HG23      THR  61   7.119  -8.671  23.007
  455    H    GLY  62           HN       GLY  62   8.515 -11.787  18.955
  456   1HA   GLY  62          HA2       GLY  62   7.777 -13.039  17.136
  457   2HA   GLY  62          HA1       GLY  62   6.522 -13.732  18.154
  458    H    HIS  63           HN       HIS  63   7.288 -10.346  17.397
  459    HA   HIS  63           HA       HIS  63   4.559 -10.084  16.310
  460   1HB   HIS  63          HB2       HIS  63   6.194  -8.018  17.809
  461   2HB   HIS  63          HB1       HIS  63   4.658  -7.687  17.014
  462    HD2  HIS  63           HD2      HIS  63   3.315 -10.581  18.188
  463    HE1  HIS  63           HE1      HIS  63   3.786  -8.534  21.856
  464    HE2  HIS  63           HE2      HIS  63   2.747 -10.545  20.716
  465    HA   PRO  64           HA       PRO  64   7.461  -9.481  12.917
  466   1HB   PRO  64          HB2       PRO  64   5.881 -10.381  10.944
  467   2HB   PRO  64          HB1       PRO  64   6.633 -11.473  12.114
  468   1HG   PRO  64          HG2       PRO  64   3.831 -10.423  12.031
  469   2HG   PRO  64          HG1       PRO  64   4.400 -12.064  12.387
  470   1HD   PRO  64          HD2       PRO  64   3.689 -10.243  14.307
  471   2HD   PRO  64          HD1       PRO  64   4.844 -11.563  14.576
  472    H    ILE  65           HN       ILE  65   4.350  -7.964  13.284
  473    HA   ILE  65           HA       ILE  65   4.936  -6.246  10.972
  474    HB   ILE  65           HB       ILE  65   2.295  -6.770  12.335
  475   1HG1  ILE  65          HG12      ILE  65   3.342  -7.358   9.557
  476   2HG1  ILE  65          HG11      ILE  65   3.011  -8.539  10.819
  477   1HG2  ILE  65          HG21      ILE  65   1.303  -5.264  10.679
  478   2HG2  ILE  65          HG22      ILE  65   2.910  -4.874  10.066
  479   3HG2  ILE  65          HG23      ILE  65   2.456  -4.411  11.706
  480   1HD1  ILE  65          HD11      ILE  65   1.263  -8.510   9.130
  481   2HD1  ILE  65          HD12      ILE  65   0.967  -6.801   9.456
  482   3HD1  ILE  65          HD13      ILE  65   0.639  -8.007  10.701
  483    H    ILE  66           HN       ILE  66   5.651  -4.337  11.303
  484    HA   ILE  66           HA       ILE  66   4.941  -2.918  13.777
  485    HB   ILE  66           HB       ILE  66   7.206  -1.821  13.620
  486   1HG1  ILE  66          HG12      ILE  66   8.887  -3.502  12.451
  487   2HG1  ILE  66          HG11      ILE  66   7.484  -3.876  11.463
  488   1HG2  ILE  66          HG21      ILE  66   6.699  -3.534  15.266
  489   2HG2  ILE  66          HG22      ILE  66   8.367  -3.673  14.710
  490   3HG2  ILE  66          HG23      ILE  66   7.141  -4.791  14.110
  491   1HD1  ILE  66          HD11      ILE  66   8.958  -2.190  10.456
  492   2HD1  ILE  66          HD12      ILE  66   8.641  -1.124  11.825
  493   3HD1  ILE  66          HD13      ILE  66   7.326  -1.586  10.744
  494    H    GLU  67           HN       GLU  67   4.877  -0.632  13.613
  495    HA   GLU  67           HA       GLU  67   4.560   0.391  10.869
  496   1HB   GLU  67          HB2       GLU  67   2.391   0.214  11.954
  497   2HB   GLU  67          HB1       GLU  67   2.992   1.066  13.368
  498   1HG   GLU  67          HG2       GLU  67   3.234   3.099  12.083
  499   2HG   GLU  67          HG1       GLU  67   2.742   2.255  10.614
  500    H    GLY  68           HN       GLY  68   5.395   2.426  10.448
  501   1HA   GLY  68          HA2       GLY  68   7.509   3.358  12.131
  502   2HA   GLY  68          HA1       GLY  68   6.909   4.150  10.678
  503    H    TYR  69           HN       TYR  69   7.053   4.274  14.040
  504    HA   TYR  69           HA       TYR  69   4.623   5.861  14.299
  505   1HB   TYR  69          HB2       TYR  69   5.329   4.074  15.982
  506   2HB   TYR  69          HB1       TYR  69   6.566   5.213  16.511
  507    HD1  TYR  69           HD1      TYR  69   3.109   5.988  15.428
  508    HD2  TYR  69           HD2      TYR  69   5.828   5.749  18.691
  509    HE1  TYR  69           HE1      TYR  69   1.453   7.079  16.875
  510    HE2  TYR  69           HE2      TYR  69   4.177   6.845  20.150
  511    HH   TYR  69           HH       TYR  69   0.900   7.330  19.162
  512    H    ASP  70           HN       ASP  70   8.112   6.205  14.824
  513    HA   ASP  70           HA       ASP  70   8.109   8.936  15.458
  514   1HB   ASP  70          HB2       ASP  70  10.116   7.849  15.932
  515   2HB   ASP  70          HB1       ASP  70  10.179   7.069  14.360
  516    HA   PRO  71           HA       PRO  71   7.735   9.880  10.893
  517   1HB   PRO  71          HB2       PRO  71   8.261   8.002   8.992
  518   2HB   PRO  71          HB1       PRO  71   9.512   9.017   9.712
  519   1HG   PRO  71          HG2       PRO  71   9.089   6.162  10.013
  520   2HG   PRO  71          HG1       PRO  71  10.457   7.145  10.558
  521   1HD   PRO  71          HD2       PRO  71   8.125   6.192  12.071
  522   2HD   PRO  71          HD1       PRO  71   9.677   6.816  12.666
  523    HA   PRO  72           HA       PRO  72   3.801   7.504  11.324
  524   1HB   PRO  72          HB2       PRO  72   2.144   9.625  11.466
  525   2HB   PRO  72          HB1       PRO  72   3.094   9.077  12.851
  526   1HG   PRO  72          HG2       PRO  72   3.622  11.339  10.968
  527   2HG   PRO  72          HG1       PRO  72   3.802  11.285  12.731
  528   1HD   PRO  72          HD2       PRO  72   5.888  11.010  10.992
  529   2HD   PRO  72          HD1       PRO  72   5.861  10.287  12.611
  530    H    GLU  73           HN       GLU  73   4.903   7.483   8.879
  531    HA   GLU  73           HA       GLU  73   3.475   8.910   6.880
  532   1HB   GLU  73          HB2       GLU  73   5.029   6.330   6.689
  533   2HB   GLU  73          HB1       GLU  73   4.517   7.311   5.324
  534   1HG   GLU  73          HG2       GLU  73   5.973   9.086   5.971
  535   2HG   GLU  73          HG1       GLU  73   6.363   8.277   7.490
  536    H    GLY  74           HN       GLY  74   3.060   5.771   8.415
  537   1HA   GLY  74          HA2       GLY  74   0.910   4.764   8.651
  538   2HA   GLY  74          HA1       GLY  74   0.396   5.599   7.192
  539    H    TRP  75           HN       TRP  75   3.014   3.354   8.085
  540    HA   TRP  75           HA       TRP  75   2.083   1.545   5.993
  541   1HB   TRP  75          HB2       TRP  75   4.469   1.135   5.300
  542   2HB   TRP  75          HB1       TRP  75   3.831   2.711   4.850
  543    HD1  TRP  75           HD1      TRP  75   5.055   4.809   5.749
  544    HE1  TRP  75           HE1      TRP  75   7.192   5.199   7.132
  545    HE3  TRP  75           HE3      TRP  75   5.892   0.009   7.302
  546    HZ2  TRP  75           HZ2      TRP  75   8.988   3.666   8.680
  547    HZ3  TRP  75           HZ3      TRP  75   7.844  -0.442   8.727
  548    HH2  TRP  75           HH2      TRP  75   9.360   1.348   9.401
  549    H    GLY  76           HN       GLY  76   2.820  -0.628   6.241
  550   1HA   GLY  76          HA2       GLY  76   3.744  -1.225   8.982
  551   2HA   GLY  76          HA1       GLY  76   2.467  -2.147   8.199
  552    H    TRP  77           HN       TRP  77   5.517  -2.409   9.097
  553    HA   TRP  77           HA       TRP  77   6.406  -3.808   6.664
  554   1HB   TRP  77          HB2       TRP  77   7.974  -2.126   7.542
  555   2HB   TRP  77          HB1       TRP  77   7.977  -2.937   9.101
  556    HD1  TRP  77           HD1      TRP  77   9.298  -5.305   9.248
  557    HE1  TRP  77           HE1      TRP  77  11.223  -6.256   7.821
  558    HE3  TRP  77           HE3      TRP  77   8.933  -2.182   5.219
  559    HZ2  TRP  77           HZ2      TRP  77  12.421  -5.741   5.325
  560    HZ3  TRP  77           HZ3      TRP  77  10.508  -2.479   3.351
  561    HH2  TRP  77           HH2      TRP  77  12.218  -4.221   3.407
  562    H    CYS  78           HN       CYS  78   6.454  -5.964   6.645
  563    HA   CYS  78           HA       CYS  78   6.028  -7.352   9.209
  564   1HB   CYS  78          HB2       CYS  78   4.342  -7.610   7.284
  565   2HB   CYS  78          HB1       CYS  78   5.587  -8.556   6.482
  566    H    TYR  79           HN       TYR  79   7.932  -7.988  10.005
  567    HA   TYR  79           HA       TYR  79  10.335  -8.063   8.665
  568   1HB   TYR  79          HB2       TYR  79   9.447  -9.461  11.174
  569   2HB   TYR  79          HB1       TYR  79  11.103  -9.570  10.584
  570    HD1  TYR  79           HD1      TYR  79  12.261  -7.282  10.078
  571    HD2  TYR  79           HD2      TYR  79   8.889  -7.737  12.633
  572    HE1  TYR  79           HE1      TYR  79  12.811  -5.153  11.171
  573    HE2  TYR  79           HE2      TYR  79   9.431  -5.604  13.732
  574    HH   TYR  79           HH       TYR  79  11.369  -4.158  14.080
  575    H    VAL  80           HN       VAL  80   8.270 -10.881   9.361
  576    HA   VAL  80           HA       VAL  80  10.080 -12.753   8.259
  577    HB   VAL  80           HB       VAL  80   8.139 -14.333   8.292
  578   1HG1  VAL  80          HG11      VAL  80   7.915 -14.321  10.756
  579   2HG1  VAL  80          HG12      VAL  80   8.695 -12.739  10.791
  580   3HG1  VAL  80          HG13      VAL  80   9.584 -14.149  10.213
  581   1HG2  VAL  80          HG21      VAL  80   6.672 -11.935   9.388
  582   2HG2  VAL  80          HG22      VAL  80   6.067 -13.591   9.373
  583   3HG2  VAL  80          HG23      VAL  80   6.349 -12.742   7.854
  584    H    ASP  81           HN       ASP  81   7.778 -10.666   6.794
  585    HA   ASP  81           HA       ASP  81   7.717 -12.246   4.320
  586   1HB   ASP  81          HB2       ASP  81   6.146  -9.810   5.187
  587   2HB   ASP  81          HB1       ASP  81   6.044 -10.508   3.577
  588    H    GLU  82           HN       GLU  82   8.862  -9.283   5.704
  589    HA   GLU  82           HA       GLU  82  10.298  -7.678   5.043
  590   1HB   GLU  82          HB2       GLU  82  10.833  -9.528   2.718
  591   2HB   GLU  82          HB1       GLU  82  11.707  -8.030   3.005
  592   1HG   GLU  82          HG2       GLU  82  12.413  -8.926   5.206
  593   2HG   GLU  82          HG1       GLU  82  11.645 -10.456   4.781
  594    H    VAL  83           HN       VAL  83   7.450  -8.014   4.070
  595    HA   VAL  83           HA       VAL  83   7.539  -6.193   1.782
  596    HB   VAL  83           HB       VAL  83   5.144  -6.628   1.504
  597   1HG1  VAL  83          HG11      VAL  83   6.811  -9.130   1.721
  598   2HG1  VAL  83          HG12      VAL  83   6.711  -8.050   0.330
  599   3HG1  VAL  83          HG13      VAL  83   5.300  -8.986   0.823
  600   1HG2  VAL  83          HG21      VAL  83   4.503  -7.013   3.812
  601   2HG2  VAL  83          HG22      VAL  83   5.454  -8.497   3.854
  602   3HG2  VAL  83          HG23      VAL  83   4.029  -8.392   2.817
  603    H    MET  84           HN       MET  84   6.762  -4.163   1.862
  604    HA   MET  84           HA       MET  84   5.802  -3.193   4.473
  605   1HB   MET  84          HB2       MET  84   7.945  -2.220   3.754
  606   2HB   MET  84          HB1       MET  84   7.202  -1.680   2.259
  607   1HG   MET  84          HG2       MET  84   5.844  -0.107   3.400
  608   2HG   MET  84          HG1       MET  84   6.278  -0.778   4.971
  609   1HE   MET  84          HE1       MET  84   9.396   1.348   2.300
  610   2HE   MET  84          HE2       MET  84   7.747   1.029   1.762
  611   3HE   MET  84          HE3       MET  84   8.855  -0.312   2.053
  612    H    PHE  85           HN       PHE  85   3.674  -3.002   4.461
  613    HA   PHE  85           HA       PHE  85   2.347  -2.197   1.954
  614   1HB   PHE  85          HB2       PHE  85   0.307  -3.272   2.909
  615   2HB   PHE  85          HB1       PHE  85   1.631  -4.396   2.637
  616    HD1  PHE  85           HD1      PHE  85  -0.481  -2.776   5.125
  617    HD2  PHE  85           HD2      PHE  85   2.825  -5.388   4.518
  618    HE1  PHE  85           HE1      PHE  85  -0.669  -3.553   7.452
  619    HE2  PHE  85           HE2      PHE  85   2.643  -6.161   6.847
  620    HZ   PHE  85           HZ       PHE  85   0.900  -5.239   8.317
  621    H    ASP  86           HN       ASP  86  -0.014  -1.321   2.688
  622    HA   ASP  86           HA       ASP  86   0.728   1.196   3.957
  623   1HB   ASP  86          HB2       ASP  86  -1.413   2.014   2.918
  624   2HB   ASP  86          HB1       ASP  86  -0.198   1.453   1.774
  625    H    LEU  87           HN       LEU  87  -0.190   2.032   5.689
  626    HA   LEU  87           HA       LEU  87  -2.608   0.829   6.833
  627   1HB   LEU  87          HB2       LEU  87  -0.037   1.426   8.306
  628   2HB   LEU  87          HB1       LEU  87  -1.573   1.198   9.118
  629    HG   LEU  87           HG       LEU  87  -0.181  -0.883   7.428
  630   1HD1  LEU  87          HD11      LEU  87  -0.468  -0.646  10.420
  631   2HD1  LEU  87          HD12      LEU  87   1.021  -0.435   9.499
  632   3HD1  LEU  87          HD13      LEU  87   0.236  -2.013   9.556
  633   1HD2  LEU  87          HD21      LEU  87  -1.871  -2.405   8.348
  634   2HD2  LEU  87          HD22      LEU  87  -2.604  -1.120   7.389
  635   3HD2  LEU  87          HD23      LEU  87  -2.655  -1.044   9.150
  636    H    SER  88           HN       SER  88  -2.574   3.013   5.251
  637    HA   SER  88           HA       SER  88  -1.797   5.445   6.432
  638   1HB   SER  88          HB2       SER  88  -2.080   5.047   3.991
  639   2HB   SER  88          HB1       SER  88  -3.826   5.016   4.230
  640    HG   SER  88           HG       SER  88  -2.021   7.175   4.482
  641    H    ASP  89           HN       ASP  89  -4.877   3.709   6.489
  642    HA   ASP  89           HA       ASP  89  -6.093   5.993   7.881
  643   1HB   ASP  89          HB2       ASP  89  -7.320   3.560   6.586
  644   2HB   ASP  89          HB1       ASP  89  -8.240   4.677   7.588
  645    H    ARG  90           HN       ARG  90  -4.598   3.084   8.524
  646    HA   ARG  90           HA       ARG  90  -6.092   2.698  11.019
  647   1HB   ARG  90          HB2       ARG  90  -4.134   0.898   9.586
  648   2HB   ARG  90          HB1       ARG  90  -4.848   0.533  11.150
  649   1HG   ARG  90          HG2       ARG  90  -7.059   0.487  10.168
  650   2HG   ARG  90          HG1       ARG  90  -6.394   0.948   8.600
  651   1HD   ARG  90          HD2       ARG  90  -5.109  -1.120   8.522
  652   2HD   ARG  90          HD1       ARG  90  -5.720  -1.574  10.112
  653    HE   ARG  90           HE       ARG  90  -7.984  -1.235   8.677
  654   1HH1  ARG  90          HH11      ARG  90  -5.062  -3.065   8.055
  655   2HH1  ARG  90          HH12      ARG  90  -5.873  -4.299   7.138
  656   1HH2  ARG  90          HH21      ARG  90  -9.058  -2.861   7.504
  657   2HH2  ARG  90          HH22      ARG  90  -8.152  -4.178   6.818
  658    H    MET  91           HN       MET  91  -3.487   4.367   9.962
  659    HA   MET  91           HA       MET  91  -1.308   3.690  11.481
  660   1HB   MET  91          HB2       MET  91  -0.538   5.997  11.249
  661   2HB   MET  91          HB1       MET  91  -1.231   5.407   9.747
  662   1HG   MET  91          HG2       MET  91  -3.221   6.670  10.086
  663   2HG   MET  91          HG1       MET  91  -2.727   7.111  11.718
  664   1HE   MET  91          HE1       MET  91  -0.442   6.992   8.504
  665   2HE   MET  91          HE2       MET  91  -0.592   8.648   7.914
  666   3HE   MET  91          HE3       MET  91  -1.986   7.567   7.877
  667    H    THR  92           HN       THR  92  -0.517   4.099  13.463
  668    HA   THR  92           HA       THR  92  -2.420   4.292  15.568
  669    HB   THR  92           HB       THR  92   0.586   4.476  15.817
  670    HG1  THR  92           HG1      THR  92   0.211   2.635  14.637
  671   1HG2  THR  92          HG21      THR  92  -1.529   3.406  17.691
  672   2HG2  THR  92          HG22      THR  92  -0.668   4.934  17.873
  673   3HG2  THR  92          HG23      THR  92   0.210   3.409  17.988
  674    HA   PRO  93           HA       PRO  93  -2.445   8.777  15.984
  675   1HB   PRO  93          HB2       PRO  93  -3.722   8.136  18.573
  676   2HB   PRO  93          HB1       PRO  93  -4.325   9.122  17.239
  677   1HG   PRO  93          HG2       PRO  93  -5.356   6.709  17.754
  678   2HG   PRO  93          HG1       PRO  93  -5.163   7.296  16.091
  679   1HD   PRO  93          HD2       PRO  93  -3.468   5.360  17.627
  680   2HD   PRO  93          HD1       PRO  93  -3.993   5.298  15.930
  681    H    HIS  94           HN       HIS  94  -1.470  10.332  17.410
  682    HA   HIS  94           HA       HIS  94   0.829   9.196  18.743
  683   1HB   HIS  94          HB2       HIS  94   1.643  11.486  18.986
  684   2HB   HIS  94          HB1       HIS  94   1.161  11.163  17.329
  685    HD1  HIS  94           HD1      HIS  94  -0.663  12.615  16.333
  686    HD2  HIS  94           HD2      HIS  94  -0.041  13.307  20.388
  687    HE1  HIS  94           HE1      HIS  94  -1.932  14.725  16.869
  688    HE2  HIS  94           HE2      HIS  94  -1.681  15.019  19.361
  689    H    ASN  95           HN       ASN  95   1.137   8.930  20.822
  690    HA   ASN  95           HA       ASN  95  -1.019   9.649  22.660
  691   1HB   ASN  95          HB2       ASN  95   0.066   8.134  24.233
  692   2HB   ASN  95          HB1       ASN  95  -0.127   7.335  22.677
  693   1HD2  ASN  95          HD21      ASN  95   1.712   6.706  24.814
  694   2HD2  ASN  95          HD22      ASN  95   3.302   6.823  24.139
  695    H    GLY  96           HN       GLY  96   1.577  11.131  21.491
  696   1HA   GLY  96          HA2       GLY  96   1.634  13.256  23.236
  697   2HA   GLY  96          HA1       GLY  96   2.878  12.147  23.805
  698    HA   PRO  97           HA       PRO  97   4.734  14.534  20.310
  699   1HB   PRO  97          HB2       PRO  97   6.458  16.042  21.914
  700   2HB   PRO  97          HB1       PRO  97   4.945  16.603  21.205
  701   1HG   PRO  97          HG2       PRO  97   5.515  16.219  23.956
  702   2HG   PRO  97          HG1       PRO  97   3.954  16.630  23.232
  703   1HD   PRO  97          HD2       PRO  97   4.974  14.010  24.169
  704   2HD   PRO  97          HD1       PRO  97   3.302  14.596  24.044
  705    H    ILE  98           HN       ILE  98   6.085  13.107  19.400
  706    HA   ILE  98           HA       ILE  98   8.002  11.625  20.959
  707    HB   ILE  98           HB       ILE  98   7.549  11.701  17.971
  708   1HG1  ILE  98          HG12      ILE  98   6.669   9.784  20.138
  709   2HG1  ILE  98          HG11      ILE  98   5.640  10.793  19.129
  710   1HG2  ILE  98          HG21      ILE  98   9.837  11.038  18.483
  711   2HG2  ILE  98          HG22      ILE  98   8.906   9.662  17.889
  712   3HG2  ILE  98          HG23      ILE  98   9.244   9.822  19.613
  713   1HD1  ILE  98          HD11      ILE  98   7.319   8.482  18.192
  714   2HD1  ILE  98          HD12      ILE  98   6.301   9.496  17.168
  715   3HD1  ILE  98          HD13      ILE  98   5.570   8.483  18.415
  716    HA   PRO  99           HA       PRO  99  11.165  14.743  20.465
  717   1HB   PRO  99          HB2       PRO  99  12.910  12.832  21.820
  718   2HB   PRO  99          HB1       PRO  99  12.357  14.417  22.364
  719   1HG   PRO  99          HG2       PRO  99  11.509  12.112  23.497
  720   2HG   PRO  99          HG1       PRO  99  10.492  13.560  23.394
  721   1HD   PRO  99          HD2       PRO  99  10.462  11.097  21.690
  722   2HD   PRO  99          HD1       PRO  99   9.100  12.040  22.334
  723    H    ARG 100           HN       ARG 100  11.671  14.709  18.311
  724    HA   ARG 100           HA       ARG 100  13.195  12.539  17.170
  725   1HB   ARG 100          HB2       ARG 100  11.685  13.702  15.701
  726   2HB   ARG 100          HB1       ARG 100  12.394  15.256  16.114
  727   1HG   ARG 100          HG2       ARG 100  13.122  14.576  13.924
  728   2HG   ARG 100          HG1       ARG 100  14.490  14.573  15.035
  729   1HD   ARG 100          HD2       ARG 100  14.660  12.614  13.699
  730   2HD   ARG 100          HD1       ARG 100  14.150  12.107  15.306
  731    HE   ARG 100           HE       ARG 100  12.223  11.285  14.394
  732   1HH1  ARG 100          HH11      ARG 100  13.597  13.623  12.155
  733   2HH1  ARG 100          HH12      ARG 100  12.503  13.216  10.867
  734   1HH2  ARG 100          HH21      ARG 100  10.839  10.715  12.686
  735   2HH2  ARG 100          HH22      ARG 100  10.938  11.556  11.162
  736    H    TYR 101           HN       TYR 101  15.212  12.293  17.877
  737    HA   TYR 101           HA       TYR 101  16.774  14.568  18.742
  738   1HB   TYR 101          HB2       TYR 101  17.462  11.625  18.639
  739   2HB   TYR 101          HB1       TYR 101  18.466  12.873  19.365
  740    HD1  TYR 101           HD1      TYR 101  17.525  14.156  21.358
  741    HD2  TYR 101           HD2      TYR 101  15.765  10.578  19.873
  742    HE1  TYR 101           HE1      TYR 101  16.374  13.834  23.508
  743    HE2  TYR 101           HE2      TYR 101  14.606  10.252  22.015
  744    HH   TYR 101           HH       TYR 101  14.947  10.940  24.408
  745    H    VAL 102           HN       VAL 102  16.877  12.149  16.167
  746    HA   VAL 102           HA       VAL 102  19.342  13.180  15.122
  747    HB   VAL 102           HB       VAL 102  18.894  11.565  13.214
  748   1HG1  VAL 102          HG11      VAL 102  19.508   9.623  14.538
  749   2HG1  VAL 102          HG12      VAL 102  18.960  10.430  16.007
  750   3HG1  VAL 102          HG13      VAL 102  20.352  11.058  15.123
  751   1HG2  VAL 102          HG21      VAL 102  17.212   9.832  13.601
  752   2HG2  VAL 102          HG22      VAL 102  16.464  11.422  13.449
  753   3HG2  VAL 102          HG23      VAL 102  16.657  10.686  15.040
  Start of MODEL    2
    1   1H    MET   1          HT1       MET   1   0.265  -0.177  -0.655
    2   2H    MET   1          HT2       MET   1   0.135   0.378  -2.251
    3   3H    MET   1          HT3       MET   1   0.884   1.346  -1.077
    4    HA   MET   1           HA       MET   1   2.491   0.303  -2.547
    5   1HB   MET   1          HB2       MET   1   2.991   0.818  -0.136
    6   2HB   MET   1          HB1       MET   1   2.611  -0.856   0.243
    7   1HG   MET   1          HG2       MET   1   5.001  -0.547   0.070
    8   2HG   MET   1          HG1       MET   1   4.422  -1.599  -1.220
    9   1HE   MET   1          HE1       MET   1   7.406   0.332  -2.893
   10   2HE   MET   1          HE2       MET   1   6.745  -1.252  -2.487
   11   3HE   MET   1          HE3       MET   1   7.300  -0.173  -1.207
   12    H    THR   2           HN       THR   2   0.806  -2.088  -0.516
   13    HA   THR   2           HA       THR   2   0.503  -3.908  -2.688
   14    HB   THR   2           HB       THR   2   2.873  -4.379  -2.157
   15    HG1  THR   2           HG1      THR   2   2.065  -6.243  -2.828
   16   1HG2  THR   2          HG21      THR   2   2.891  -3.761   0.201
   17   2HG2  THR   2          HG22      THR   2   3.469  -5.415  -0.009
   18   3HG2  THR   2          HG23      THR   2   1.833  -5.120   0.579
   19    H    MET   3           HN       MET   3  -0.524  -6.000  -1.848
   20    HA   MET   3           HA       MET   3  -2.579  -5.282   0.028
   21   1HB   MET   3          HB2       MET   3  -2.015  -7.975  -1.225
   22   2HB   MET   3          HB1       MET   3  -3.505  -7.488  -0.428
   23   1HG   MET   3          HG2       MET   3  -2.389  -6.392  -2.997
   24   2HG   MET   3          HG1       MET   3  -3.804  -7.425  -2.807
   25   1HE   MET   3          HE1       MET   3  -3.686  -4.614  -4.415
   26   2HE   MET   3          HE2       MET   3  -5.244  -3.931  -3.948
   27   3HE   MET   3          HE3       MET   3  -5.115  -5.645  -4.345
   28    H    GLY   4           HN       GLY   4   0.489  -6.730   0.223
   29   1HA   GLY   4          HA2       GLY   4   1.706  -7.076   2.165
   30   2HA   GLY   4          HA1       GLY   4   0.232  -6.852   3.094
   31    H    CYS   5           HN       CYS   5  -0.613  -8.579   4.029
   32    HA   CYS   5           HA       CYS   5  -0.534 -11.188   2.892
   33   1HB   CYS   5          HB2       CYS   5   0.874 -12.244   4.631
   34   2HB   CYS   5          HB1       CYS   5   1.785 -11.114   3.636
   35    H    ARG   6           HN       ARG   6  -1.443 -12.828   4.497
   36    HA   ARG   6           HA       ARG   6  -3.860 -11.771   5.482
   37   1HB   ARG   6          HB2       ARG   6  -4.342 -14.003   6.278
   38   2HB   ARG   6          HB1       ARG   6  -3.605 -14.083   4.686
   39   1HG   ARG   6          HG2       ARG   6  -1.451 -14.648   5.735
   40   2HG   ARG   6          HG1       ARG   6  -2.241 -14.631   7.314
   41   1HD   ARG   6          HD2       ARG   6  -2.093 -16.903   6.535
   42   2HD   ARG   6          HD1       ARG   6  -3.781 -16.395   6.513
   43    HE   ARG   6           HE       ARG   6  -2.048 -16.687   4.143
   44   1HH1  ARG   6          HH11      ARG   6  -5.238 -16.458   5.588
   45   2HH1  ARG   6          HH12      ARG   6  -6.065 -16.899   4.130
   46   1HH2  ARG   6          HH21      ARG   6  -3.143 -17.284   2.223
   47   2HH2  ARG   6          HH22      ARG   6  -4.883 -17.371   2.222
   48    H    HIS   7           HN       HIS   7  -0.792 -11.942   6.944
   49    HA   HIS   7           HA       HIS   7  -1.477 -12.133   9.661
   50   1HB   HIS   7          HB2       HIS   7   0.830 -10.707   8.322
   51   2HB   HIS   7          HB1       HIS   7   0.685 -10.908  10.063
   52    HD2  HIS   7           HD2      HIS   7  -0.171 -14.084  10.048
   53    HE1  HIS   7           HE1      HIS   7   3.529 -14.538   8.056
   54    HE2  HIS   7           HE2      HIS   7   1.812 -15.677   9.529
   55    H    VAL   8           HN       VAL   8  -1.766  -9.534   7.379
   56    HA   VAL   8           HA       VAL   8  -1.878  -7.360   9.204
   57    HB   VAL   8           HB       VAL   8  -3.252  -7.487   6.521
   58   1HG1  VAL   8          HG11      VAL   8  -3.848  -5.564   7.891
   59   2HG1  VAL   8          HG12      VAL   8  -2.896  -5.077   6.488
   60   3HG1  VAL   8          HG13      VAL   8  -2.141  -5.163   8.079
   61   1HG2  VAL   8          HG21      VAL   8  -0.978  -8.205   6.231
   62   2HG2  VAL   8          HG22      VAL   8  -0.395  -6.801   7.126
   63   3HG2  VAL   8          HG23      VAL   8  -1.193  -6.586   5.568
   64    H    ALA   9           HN       ALA   9  -4.163  -9.740   8.144
   65    HA   ALA   9           HA       ALA   9  -6.494  -8.265   8.751
   66   1HB   ALA   9          HB1       ALA   9  -6.476 -10.153   7.179
   67   2HB   ALA   9          HB2       ALA   9  -7.695 -10.344   8.438
   68   3HB   ALA   9          HB3       ALA   9  -6.187 -11.255   8.526
   69    H    GLY  10           HN       GLY  10  -4.194  -9.602  10.766
   70   1HA   GLY  10          HA2       GLY  10  -6.118 -10.179  12.912
   71   2HA   GLY  10          HA1       GLY  10  -4.436 -10.683  12.887
   72    H    ILE  11           HN       ILE  11  -3.883  -7.790  11.896
   73    HA   ILE  11           HA       ILE  11  -3.280  -6.857  14.564
   74    HB   ILE  11           HB       ILE  11  -2.017  -5.068  13.510
   75   1HG1  ILE  11          HG12      ILE  11  -2.982  -6.189  10.869
   76   2HG1  ILE  11          HG11      ILE  11  -3.562  -4.694  11.593
   77   1HG2  ILE  11          HG21      ILE  11  -0.355  -6.426  12.338
   78   2HG2  ILE  11          HG22      ILE  11  -1.524  -7.739  12.200
   79   3HG2  ILE  11          HG23      ILE  11  -0.948  -7.235  13.790
   80   1HD1  ILE  11          HD11      ILE  11  -1.311  -3.752  11.426
   81   2HD1  ILE  11          HD12      ILE  11  -1.936  -4.251   9.854
   82   3HD1  ILE  11          HD13      ILE  11  -0.747  -5.251  10.689
   83    H    ARG  12           HN       ARG  12  -3.826  -4.786  15.367
   84    HA   ARG  12           HA       ARG  12  -6.190  -3.553  14.146
   85   1HB   ARG  12          HB2       ARG  12  -7.193  -3.302  16.418
   86   2HB   ARG  12          HB1       ARG  12  -7.118  -4.961  15.851
   87   1HG   ARG  12          HG2       ARG  12  -4.998  -3.841  17.650
   88   2HG   ARG  12          HG1       ARG  12  -6.516  -4.473  18.293
   89   1HD   ARG  12          HD2       ARG  12  -6.078  -6.616  17.177
   90   2HD   ARG  12          HD1       ARG  12  -4.550  -5.981  16.571
   91    HE   ARG  12           HE       ARG  12  -4.608  -5.734  19.373
   92   1HH1  ARG  12          HH11      ARG  12  -4.426  -8.190  16.884
   93   2HH1  ARG  12          HH12      ARG  12  -3.541  -9.312  17.869
   94   1HH2  ARG  12          HH21      ARG  12  -3.442  -7.190  20.674
   95   2HH2  ARG  12          HH22      ARG  12  -2.987  -8.748  20.041
   96    H    THR  13           HN       THR  13  -6.710  -1.445  15.494
   97    HA   THR  13           HA       THR  13  -4.275   0.114  15.528
   98    HB   THR  13           HB       THR  13  -7.082   0.999  16.236
   99    HG1  THR  13           HG1      THR  13  -6.840   1.858  13.946
  100   1HG2  THR  13          HG21      THR  13  -5.309   2.523  16.994
  101   2HG2  THR  13          HG22      THR  13  -6.246   3.237  15.681
  102   3HG2  THR  13          HG23      THR  13  -4.646   2.566  15.360
  103    H    VAL  14           HN       VAL  14  -3.010   0.088  17.240
  104    HA   VAL  14           HA       VAL  14  -4.147  -0.754  19.805
  105    HB   VAL  14           HB       VAL  14  -1.784  -1.288  20.406
  106   1HG1  VAL  14          HG11      VAL  14  -2.890  -2.586  17.918
  107   2HG1  VAL  14          HG12      VAL  14  -3.239  -3.035  19.589
  108   3HG1  VAL  14          HG13      VAL  14  -1.618  -3.268  18.933
  109   1HG2  VAL  14          HG21      VAL  14  -1.279  -0.576  17.517
  110   2HG2  VAL  14          HG22      VAL  14  -0.127  -1.384  18.580
  111   3HG2  VAL  14          HG23      VAL  14  -0.645   0.264  18.933
  112    H    THR  15           HN       THR  15  -2.758   0.033  21.722
  113    HA   THR  15           HA       THR  15  -2.583   2.955  21.580
  114    HB   THR  15           HB       THR  15  -2.493   1.200  24.042
  115    HG1  THR  15           HG1      THR  15  -4.691   2.346  22.637
  116   1HG2  THR  15          HG21      THR  15  -3.125   4.133  23.684
  117   2HG2  THR  15          HG22      THR  15  -1.627   3.474  24.343
  118   3HG2  THR  15          HG23      THR  15  -3.146   3.250  25.211
  119    HA   PRO  16           HA       PRO  16   1.883   2.499  21.540
  120   1HB   PRO  16          HB2       PRO  16   1.868   5.368  22.198
  121   2HB   PRO  16          HB1       PRO  16   2.556   4.543  20.798
  122   1HG   PRO  16          HG2       PRO  16   0.357   6.073  20.598
  123   2HG   PRO  16          HG1       PRO  16   0.582   4.615  19.613
  124   1HD   PRO  16          HD2       PRO  16  -1.088   5.008  22.068
  125   2HD   PRO  16          HD1       PRO  16  -1.454   4.096  20.588
  126    H    SER  17           HN       SER  17   2.623   1.492  23.304
  127    HA   SER  17           HA       SER  17   2.004   2.264  25.967
  128   1HB   SER  17          HB2       SER  17   2.521  -0.066  25.253
  129   2HB   SER  17          HB1       SER  17   4.195   0.416  24.988
  130    HG   SER  17           HG       SER  17   4.470   0.715  27.150
  131    H    ALA  18           HN       ALA  18   4.293   3.422  23.746
  132    HA   ALA  18           HA       ALA  18   5.692   4.867  25.865
  133   1HB   ALA  18          HB1       ALA  18   7.879   4.388  24.902
  134   2HB   ALA  18          HB2       ALA  18   7.131   3.361  23.678
  135   3HB   ALA  18          HB3       ALA  18   7.073   2.893  25.378
  136    H    LEU  19           HN       LEU  19   6.877   6.740  25.053
  137    HA   LEU  19           HA       LEU  19   5.608   7.903  22.701
  138   1HB   LEU  19          HB2       LEU  19   7.484   9.031  24.775
  139   2HB   LEU  19          HB1       LEU  19   7.005   9.928  23.350
  140    HG   LEU  19           HG       LEU  19   5.600  10.732  25.016
  141   1HD1  LEU  19          HD11      LEU  19   4.008   8.528  23.730
  142   2HD1  LEU  19          HD12      LEU  19   4.400  10.073  22.977
  143   3HD1  LEU  19          HD13      LEU  19   3.380  10.027  24.415
  144   1HD2  LEU  19          HD21      LEU  19   5.135   7.896  25.919
  145   2HD2  LEU  19          HD22      LEU  19   4.358   9.330  26.592
  146   3HD2  LEU  19          HD23      LEU  19   6.102   9.116  26.750
  147    H    GLY  20           HN       GLY  20   8.814   7.032  23.861
  148   1HA   GLY  20          HA2       GLY  20   9.675   6.854  21.052
  149   2HA   GLY  20          HA1       GLY  20  10.707   7.625  22.253
  150    H    CYS  21           HN       CYS  21  12.372   6.099  21.971
  151    HA   CYS  21           HA       CYS  21  11.867   3.326  22.518
  152   1HB   CYS  21          HB2       CYS  21  13.754   4.046  21.081
  153   2HB   CYS  21          HB1       CYS  21  14.495   4.829  22.473
  154    HG   CYS  21           HG       CYS  21  16.009   2.736  22.679
  155    H    GLU  22           HN       GLU  22  11.055   2.945  24.472
  156    HA   GLU  22           HA       GLU  22  11.434   4.495  26.757
  157   1HB   GLU  22          HB2       GLU  22  10.276   2.780  27.957
  158   2HB   GLU  22          HB1       GLU  22   9.559   2.893  26.357
  159   1HG   GLU  22          HG2       GLU  22  11.487   0.783  27.310
  160   2HG   GLU  22          HG1       GLU  22   9.756   0.587  27.050
  161    H    GLU  23           HN       GLU  23  13.165   1.652  25.622
  162    HA   GLU  23           HA       GLU  23  14.722   1.194  27.909
  163   1HB   GLU  23          HB2       GLU  23  14.493  -0.404  26.053
  164   2HB   GLU  23          HB1       GLU  23  15.400   0.680  25.009
  165   1HG   GLU  23          HG2       GLU  23  17.388   0.360  26.271
  166   2HG   GLU  23          HG1       GLU  23  16.514  -0.510  27.532
  167    H    CYS  24           HN       CYS  24  15.277   3.261  25.079
  168    HA   CYS  24           HA       CYS  24  17.841   4.130  25.923
  169   1HB   CYS  24          HB2       CYS  24  15.831   5.352  24.025
  170   2HB   CYS  24          HB1       CYS  24  17.422   6.043  24.314
  171    HG   CYS  24           HG       CYS  24  18.203   4.834  22.163
  172    H    LEU  25           HN       LEU  25  14.573   5.213  26.548
  173    HA   LEU  25           HA       LEU  25  15.233   7.729  27.667
  174   1HB   LEU  25          HB2       LEU  25  12.808   5.963  27.902
  175   2HB   LEU  25          HB1       LEU  25  12.913   7.527  28.688
  176    HG   LEU  25           HG       LEU  25  13.209   7.145  25.712
  177   1HD1  LEU  25          HD11      LEU  25  10.981   6.442  26.407
  178   2HD1  LEU  25          HD12      LEU  25  10.913   7.976  25.539
  179   3HD1  LEU  25          HD13      LEU  25  10.771   7.950  27.297
  180   1HD2  LEU  25          HD21      LEU  25  14.240   9.165  26.597
  181   2HD2  LEU  25          HD22      LEU  25  12.738   9.588  27.419
  182   3HD2  LEU  25          HD23      LEU  25  12.801   9.562  25.657
  183    H    LYS  26           HN       LYS  26  15.605   4.566  28.902
  184    HA   LYS  26           HA       LYS  26  15.196   5.310  31.664
  185   1HB   LYS  26          HB2       LYS  26  15.504   3.068  32.195
  186   2HB   LYS  26          HB1       LYS  26  14.822   2.984  30.578
  187   1HG   LYS  26          HG2       LYS  26  17.249   2.862  29.769
  188   2HG   LYS  26          HG1       LYS  26  17.645   2.508  31.452
  189   1HD   LYS  26          HD2       LYS  26  15.986   0.636  31.358
  190   2HD   LYS  26          HD1       LYS  26  15.832   0.947  29.626
  191   1HE   LYS  26          HE2       LYS  26  18.150   0.440  29.271
  192   2HE   LYS  26          HE1       LYS  26  18.427   0.289  31.006
  193   1HZ   LYS  26          HZ1       LYS  26  16.563  -1.450  29.483
  194   2HZ   LYS  26          HZ2       LYS  26  17.086  -1.654  31.084
  195   3HZ   LYS  26          HZ3       LYS  26  18.176  -1.855  29.802
  196    H    ILE  27           HN       ILE  27  17.805   5.345  29.417
  197    HA   ILE  27           HA       ILE  27  19.674   5.903  31.624
  198    HB   ILE  27           HB       ILE  27  21.490   4.912  30.189
  199   1HG1  ILE  27          HG12      ILE  27  19.101   3.844  28.667
  200   2HG1  ILE  27          HG11      ILE  27  20.376   4.880  28.045
  201   1HG2  ILE  27          HG21      ILE  27  19.329   3.061  31.179
  202   2HG2  ILE  27          HG22      ILE  27  20.629   3.764  32.141
  203   3HG2  ILE  27          HG23      ILE  27  21.003   2.609  30.862
  204   1HD1  ILE  27          HD11      ILE  27  21.992   3.084  28.341
  205   2HD1  ILE  27          HD12      ILE  27  20.656   2.588  27.302
  206   3HD1  ILE  27          HD13      ILE  27  20.720   2.041  28.977
  207    H    GLY  28           HN       GLY  28  18.094   7.357  29.239
  208   1HA   GLY  28          HA2       GLY  28  18.404   9.434  28.279
  209   2HA   GLY  28          HA1       GLY  28  19.943   9.537  29.121
  210    H    SER  29           HN       SER  29  18.764   7.206  26.741
  211    HA   SER  29           HA       SER  29  21.139   7.771  25.110
  212   1HB   SER  29          HB2       SER  29  19.344   5.332  25.166
  213   2HB   SER  29          HB1       SER  29  20.789   5.516  24.177
  214    HG   SER  29           HG       SER  29  22.037   5.552  26.012
  215    HA   PRO  30           HA       PRO  30  18.476   9.222  21.883
  216   1HB   PRO  30          HB2       PRO  30  20.150   9.158  19.807
  217   2HB   PRO  30          HB1       PRO  30  20.442  10.231  21.182
  218   1HG   PRO  30          HG2       PRO  30  21.712   7.608  20.520
  219   2HG   PRO  30          HG1       PRO  30  22.455   9.082  21.165
  220   1HD   PRO  30          HD2       PRO  30  21.705   6.883  22.678
  221   2HD   PRO  30          HD1       PRO  30  21.953   8.521  23.315
  222    H    TRP  31           HN       TRP  31  17.674   8.695  19.705
  223    HA   TRP  31           HA       TRP  31  18.051   6.008  18.716
  224   1HB   TRP  31          HB2       TRP  31  15.623   5.532  18.580
  225   2HB   TRP  31          HB1       TRP  31  16.178   5.648  20.245
  226    HD1  TRP  31           HD1      TRP  31  14.120   7.637  17.645
  227    HE1  TRP  31           HE1      TRP  31  12.568   9.244  18.917
  228    HE3  TRP  31           HE3      TRP  31  15.825   6.829  22.399
  229    HZ2  TRP  31           HZ2      TRP  31  12.118  10.059  21.578
  230    HZ3  TRP  31           HZ3      TRP  31  14.776   8.062  24.250
  231    HH2  TRP  31           HH2      TRP  31  12.960   9.643  23.846
  232    H    VAL  32           HN       VAL  32  17.214   5.797  16.512
  233    HA   VAL  32           HA       VAL  32  17.242   8.416  15.203
  234    HB   VAL  32           HB       VAL  32  17.512   5.714  13.879
  235   1HG1  VAL  32          HG11      VAL  32  18.201   8.500  12.943
  236   2HG1  VAL  32          HG12      VAL  32  16.831   7.533  12.399
  237   3HG1  VAL  32          HG13      VAL  32  18.477   7.011  12.039
  238   1HG2  VAL  32          HG21      VAL  32  19.319   5.995  15.486
  239   2HG2  VAL  32          HG22      VAL  32  19.684   7.588  14.822
  240   3HG2  VAL  32          HG23      VAL  32  19.932   6.145  13.838
  241    H    HIS  33           HN       HIS  33  15.553   5.288  14.843
  242    HA   HIS  33           HA       HIS  33  13.122   6.800  14.197
  243   1HB   HIS  33          HB2       HIS  33  14.234   4.443  12.678
  244   2HB   HIS  33          HB1       HIS  33  12.558   4.963  12.541
  245    HD1  HIS  33           HD1      HIS  33  12.349   7.647  11.823
  246    HD2  HIS  33           HD2      HIS  33  15.857   5.612  10.873
  247    HE1  HIS  33           HE1      HIS  33  13.451   8.993  10.003
  248    HE2  HIS  33           HE2      HIS  33  15.662   7.851   9.594
  249    H    LEU  34           HN       LEU  34  11.143   5.401  14.307
  250    HA   LEU  34           HA       LEU  34  11.354   3.457  16.515
  251   1HB   LEU  34          HB2       LEU  34   9.386   5.741  16.355
  252   2HB   LEU  34          HB1       LEU  34   9.413   4.501  17.593
  253    HG   LEU  34           HG       LEU  34  11.628   6.499  17.132
  254   1HD1  LEU  34          HD11      LEU  34  10.813   7.563  19.182
  255   2HD1  LEU  34          HD12      LEU  34   9.445   6.451  19.209
  256   3HD1  LEU  34          HD13      LEU  34   9.609   7.615  17.895
  257   1HD2  LEU  34          HD21      LEU  34  11.124   4.558  19.384
  258   2HD2  LEU  34          HD22      LEU  34  12.447   5.722  19.287
  259   3HD2  LEU  34          HD23      LEU  34  12.358   4.389  18.135
  260    H    ARG  35           HN       ARG  35  10.176   1.678  16.195
  261    HA   ARG  35           HA       ARG  35   7.889   1.824  14.343
  262   1HB   ARG  35          HB2       ARG  35   9.832  -0.485  14.589
  263   2HB   ARG  35          HB1       ARG  35   8.423  -0.430  13.537
  264   1HG   ARG  35          HG2       ARG  35   9.430   1.483  12.347
  265   2HG   ARG  35          HG1       ARG  35  10.862   1.326  13.361
  266   1HD   ARG  35          HD2       ARG  35   9.796  -0.658  11.361
  267   2HD   ARG  35          HD1       ARG  35  11.298   0.257  11.268
  268    HE   ARG  35           HE       ARG  35  10.830  -1.790  13.336
  269   1HH1  ARG  35          HH11      ARG  35  12.887  -0.288  10.929
  270   2HH1  ARG  35          HH12      ARG  35  14.158  -1.468  11.106
  271   1HH2  ARG  35          HH21      ARG  35  12.489  -3.360  13.535
  272   2HH2  ARG  35          HH22      ARG  35  13.926  -3.199  12.572
  273    H    ILE  36           HN       ILE  36   6.039   1.144  15.173
  274    HA   ILE  36           HA       ILE  36   6.113  -0.136  17.829
  275    HB   ILE  36           HB       ILE  36   5.051   2.051  17.830
  276   1HG1  ILE  36          HG12      ILE  36   3.012  -0.174  18.060
  277   2HG1  ILE  36          HG11      ILE  36   4.111   0.355  19.328
  278   1HG2  ILE  36          HG21      ILE  36   3.191   0.937  15.734
  279   2HG2  ILE  36          HG22      ILE  36   4.413   2.186  15.494
  280   3HG2  ILE  36          HG23      ILE  36   3.020   2.502  16.528
  281   1HD1  ILE  36          HD11      ILE  36   1.903   1.993  18.105
  282   2HD1  ILE  36          HD12      ILE  36   3.009   2.534  19.368
  283   3HD1  ILE  36          HD13      ILE  36   1.878   1.220  19.690
  284    H    CYS  37           HN       CYS  37   4.991  -2.032  18.204
  285    HA   CYS  37           HA       CYS  37   4.199  -3.671  16.028
  286   1HB   CYS  37          HB2       CYS  37   3.572  -3.828  18.970
  287   2HB   CYS  37          HB1       CYS  37   2.989  -5.012  17.817
  288    H    ARG  38           HN       ARG  38   2.226  -4.007  15.078
  289    HA   ARG  38           HA       ARG  38  -0.034  -2.386  15.935
  290   1HB   ARG  38          HB2       ARG  38   0.294  -4.395  13.697
  291   2HB   ARG  38          HB1       ARG  38  -1.202  -3.533  14.024
  292   1HG   ARG  38          HG2       ARG  38   1.422  -2.233  13.326
  293   2HG   ARG  38          HG1       ARG  38   0.098  -2.531  12.198
  294   1HD   ARG  38          HD2       ARG  38   0.004  -0.783  14.654
  295   2HD   ARG  38          HD1       ARG  38   0.049  -0.231  12.980
  296    HE   ARG  38           HE       ARG  38  -2.181  -1.920  13.850
  297   1HH1  ARG  38          HH11      ARG  38  -0.997   1.221  12.832
  298   2HH1  ARG  38          HH12      ARG  38  -2.598   1.856  12.566
  299   1HH2  ARG  38          HH21      ARG  38  -4.270  -1.066  13.472
  300   2HH2  ARG  38          HH22      ARG  38  -4.439   0.575  12.936
  301    H    THR  39           HN       THR  39   1.349  -4.957  17.143
  302    HA   THR  39           HA       THR  39  -1.061  -6.507  17.715
  303    HB   THR  39           HB       THR  39   1.627  -7.347  18.687
  304    HG1  THR  39           HG1      THR  39   1.025  -8.119  16.074
  305   1HG2  THR  39          HG21      THR  39   0.760  -9.568  18.074
  306   2HG2  THR  39          HG22      THR  39  -0.709  -8.813  17.454
  307   3HG2  THR  39          HG23      THR  39  -0.323  -8.714  19.174
  308    H    CYS  40           HN       CYS  40   1.876  -5.725  19.606
  309    HA   CYS  40           HA       CYS  40   0.230  -5.718  22.001
  310   1HB   CYS  40          HB2       CYS  40   2.212  -6.077  23.252
  311   2HB   CYS  40          HB1       CYS  40   2.376  -7.061  21.809
  312    H    GLY  41           HN       GLY  41   1.273  -3.411  19.874
  313   1HA   GLY  41          HA2       GLY  41   1.166  -1.119  19.963
  314   2HA   GLY  41          HA1       GLY  41   0.452  -1.289  21.555
  315    H    HIS  42           HN       HIS  42   3.522  -2.760  21.242
  316    HA   HIS  42           HA       HIS  42   4.671  -0.644  22.879
  317   1HB   HIS  42          HB2       HIS  42   4.855  -3.115  23.482
  318   2HB   HIS  42          HB1       HIS  42   5.980  -3.265  22.137
  319    HD1  HIS  42           HD1      HIS  42   5.724  -2.133  25.644
  320    HD2  HIS  42           HD2      HIS  42   8.448  -1.881  22.515
  321    HE1  HIS  42           HE1      HIS  42   7.870  -1.330  26.673
  322    HE2  HIS  42           HE2      HIS  42   9.365  -0.859  24.699
  323    H    VAL  43           HN       VAL  43   6.330   0.632  22.266
  324    HA   VAL  43           HA       VAL  43   6.932   0.703  19.411
  325    HB   VAL  43           HB       VAL  43   7.662   2.716  21.549
  326   1HG1  VAL  43          HG11      VAL  43   7.945   4.264  19.684
  327   2HG1  VAL  43          HG12      VAL  43   7.544   2.978  18.546
  328   3HG1  VAL  43          HG13      VAL  43   9.013   2.870  19.517
  329   1HG2  VAL  43          HG21      VAL  43   5.738   4.015  20.804
  330   2HG2  VAL  43          HG22      VAL  43   5.236   2.441  21.424
  331   3HG2  VAL  43          HG23      VAL  43   5.292   2.727  19.684
  332    H    GLY  44           HN       GLY  44   8.972   0.396  18.581
  333   1HA   GLY  44          HA2       GLY  44  11.179   0.082  20.512
  334   2HA   GLY  44          HA1       GLY  44  10.910  -1.126  19.263
  335    H    CYS  45           HN       CYS  45  13.162   0.841  19.851
  336    HA   CYS  45           HA       CYS  45  13.205   2.620  17.616
  337   1HB   CYS  45          HB2       CYS  45  15.469   3.104  18.229
  338   2HB   CYS  45          HB1       CYS  45  14.565   2.911  19.727
  339    HG   CYS  45           HG       CYS  45  16.353   0.336  18.399
  340    H    CYS  46           HN       CYS  46  14.196   2.370  15.637
  341    HA   CYS  46           HA       CYS  46  13.992  -0.199  14.531
  342   1HB   CYS  46          HB2       CYS  46  15.302   2.279  13.413
  343   2HB   CYS  46          HB1       CYS  46  14.905   0.837  12.483
  344    HG   CYS  46           HG       CYS  46  12.797   2.110  11.693
  345    H    ASP  47           HN       ASP  47  15.733  -1.095  13.072
  346    HA   ASP  47           HA       ASP  47  17.968  -1.866  14.689
  347   1HB   ASP  47          HB2       ASP  47  18.576  -3.211  12.639
  348   2HB   ASP  47          HB1       ASP  47  16.983  -3.549  13.310
  349    H    ASP  48           HN       ASP  48  17.380   0.760  12.767
  350    HA   ASP  48           HA       ASP  48  20.118   1.130  11.870
  351   1HB   ASP  48          HB2       ASP  48  19.343   3.020  10.715
  352   2HB   ASP  48          HB1       ASP  48  17.981   1.909  10.633
  353    H    SER  49           HN       SER  49  18.366   1.500  14.656
  354    HA   SER  49           HA       SER  49  19.902   3.778  15.648
  355   1HB   SER  49          HB2       SER  49  17.630   2.238  16.935
  356   2HB   SER  49          HB1       SER  49  18.341   3.736  17.536
  357    HG   SER  49           HG       SER  49  17.309   3.638  14.912
  358    HA   PRO  50           HA       PRO  50  22.983   1.601  17.774
  359   1HB   PRO  50          HB2       PRO  50  22.758   2.564  20.376
  360   2HB   PRO  50          HB1       PRO  50  23.642   3.338  19.058
  361   1HG   PRO  50          HG2       PRO  50  20.891   3.891  20.079
  362   2HG   PRO  50          HG1       PRO  50  22.132   5.028  19.521
  363   1HD   PRO  50          HD2       PRO  50  20.057   4.397  17.970
  364   2HD   PRO  50          HD1       PRO  50  21.680   4.608  17.277
  365    H    HIS  51           HN       HIS  51  19.842   1.476  19.382
  366    HA   HIS  51           HA       HIS  51  20.691  -0.767  21.020
  367   1HB   HIS  51          HB2       HIS  51  18.235   0.934  20.929
  368   2HB   HIS  51          HB1       HIS  51  18.154  -0.647  21.696
  369    HD1  HIS  51           HD1      HIS  51  18.367  -0.410  24.139
  370    HD2  HIS  51           HD2      HIS  51  20.785   2.306  22.105
  371    HE1  HIS  51           HE1      HIS  51  19.570   0.903  25.920
  372    HE2  HIS  51           HE2      HIS  51  21.221   2.338  24.657
  373    H    LYS  52           HN       LYS  52  18.779  -0.214  18.139
  374    HA   LYS  52           HA       LYS  52  17.530  -1.574  16.789
  375   1HB   LYS  52          HB2       LYS  52  19.497  -3.666  17.752
  376   2HB   LYS  52          HB1       LYS  52  18.488  -3.788  16.321
  377   1HG   LYS  52          HG2       LYS  52  19.647  -1.887  15.328
  378   2HG   LYS  52          HG1       LYS  52  20.656  -1.749  16.768
  379   1HD   LYS  52          HD2       LYS  52  20.527  -4.211  15.033
  380   2HD   LYS  52          HD1       LYS  52  21.731  -2.936  14.843
  381   1HE   LYS  52          HE2       LYS  52  22.474  -3.325  17.157
  382   2HE   LYS  52          HE1       LYS  52  21.299  -4.631  17.301
  383   1HZ   LYS  52          HZ1       LYS  52  23.521  -4.563  15.326
  384   2HZ   LYS  52          HZ2       LYS  52  22.446  -5.847  15.586
  385   3HZ   LYS  52          HZ3       LYS  52  23.558  -5.414  16.791
  386    H    HIS  53           HN       HIS  53  16.471  -1.225  19.364
  387    HA   HIS  53           HA       HIS  53  15.920  -3.639  20.710
  388   1HB   HIS  53          HB2       HIS  53  15.857  -1.276  21.651
  389   2HB   HIS  53          HB1       HIS  53  14.277  -1.117  20.895
  390    HD1  HIS  53           HD1      HIS  53  12.737  -1.110  22.860
  391    HD2  HIS  53           HD2      HIS  53  15.530  -4.191  23.043
  392    HE1  HIS  53           HE1      HIS  53  12.086  -2.503  24.852
  393    HE2  HIS  53           HE2      HIS  53  13.784  -4.364  24.948
  394    H    ALA  54           HN       ALA  54  14.333  -2.022  18.055
  395    HA   ALA  54           HA       ALA  54  11.784  -3.212  18.311
  396   1HB   ALA  54          HB1       ALA  54  13.149  -2.216  15.816
  397   2HB   ALA  54          HB2       ALA  54  12.167  -1.251  16.919
  398   3HB   ALA  54          HB3       ALA  54  11.428  -2.555  15.990
  399    H    THR  55           HN       THR  55  14.717  -4.278  16.627
  400    HA   THR  55           HA       THR  55  13.406  -6.501  15.379
  401    HB   THR  55           HB       THR  55  15.758  -7.251  14.857
  402    HG1  THR  55           HG1      THR  55  17.435  -5.797  15.349
  403   1HG2  THR  55          HG21      THR  55  15.050  -4.413  14.112
  404   2HG2  THR  55          HG22      THR  55  14.476  -5.868  13.296
  405   3HG2  THR  55          HG23      THR  55  16.190  -5.452  13.257
  406    H    ARG  56           HN       ARG  56  15.587  -6.071  18.126
  407    HA   ARG  56           HA       ARG  56  15.769  -8.725  18.963
  408   1HB   ARG  56          HB2       ARG  56  15.761  -6.207  20.644
  409   2HB   ARG  56          HB1       ARG  56  16.329  -7.783  21.181
  410   1HG   ARG  56          HG2       ARG  56  18.123  -7.749  19.595
  411   2HG   ARG  56          HG1       ARG  56  17.497  -6.276  18.853
  412   1HD   ARG  56          HD2       ARG  56  19.360  -5.719  20.272
  413   2HD   ARG  56          HD1       ARG  56  17.878  -5.085  20.983
  414    HE   ARG  56           HE       ARG  56  17.963  -7.092  22.477
  415   1HH1  ARG  56          HH11      ARG  56  20.874  -5.790  21.023
  416   2HH1  ARG  56          HH12      ARG  56  21.917  -6.387  22.277
  417   1HH2  ARG  56          HH21      ARG  56  19.331  -7.853  24.145
  418   2HH2  ARG  56          HH22      ARG  56  21.044  -7.554  24.048
  419    H    HIS  57           HN       HIS  57  13.390  -6.229  19.763
  420    HA   HIS  57           HA       HIS  57  11.831  -7.662  21.572
  421   1HB   HIS  57          HB2       HIS  57  11.503  -5.290  21.276
  422   2HB   HIS  57          HB1       HIS  57  11.063  -5.511  19.587
  423    HD1  HIS  57           HD1      HIS  57   9.641  -5.667  23.048
  424    HD2  HIS  57           HD2      HIS  57   8.483  -6.476  19.137
  425    HE1  HIS  57           HE1      HIS  57   7.119  -5.938  23.085
  426    H    PHE  58           HN       PHE  58  11.634  -7.522  18.023
  427    HA   PHE  58           HA       PHE  58   9.323  -9.051  17.694
  428   1HB   PHE  58          HB2       PHE  58  10.071  -7.979  15.754
  429   2HB   PHE  58          HB1       PHE  58  11.716  -8.575  15.943
  430    HD1  PHE  58           HD1      PHE  58   8.333 -10.168  15.713
  431    HD2  PHE  58           HD2      PHE  58  12.327 -10.007  14.283
  432    HE1  PHE  58           HE1      PHE  58   7.858 -12.034  14.183
  433    HE2  PHE  58           HE2      PHE  58  11.866 -11.871  12.751
  434    HZ   PHE  58           HZ       PHE  58   9.626 -12.890  12.700
  435    H    HIS  59           HN       HIS  59  12.713 -10.103  17.862
  436    HA   HIS  59           HA       HIS  59  12.117 -12.822  17.327
  437   1HB   HIS  59          HB2       HIS  59  14.554 -11.569  18.602
  438   2HB   HIS  59          HB1       HIS  59  14.438 -13.264  18.142
  439    HD1  HIS  59           HD1      HIS  59  13.871 -13.601  15.441
  440    HD2  HIS  59           HD2      HIS  59  15.540  -9.981  16.640
  441    HE1  HIS  59           HE1      HIS  59  14.825 -12.567  13.358
  442    HE2  HIS  59           HE2      HIS  59  15.657 -10.298  14.070
  443    H    ALA  60           HN       ALA  60  12.081 -10.927  20.223
  444    HA   ALA  60           HA       ALA  60  12.083 -13.211  21.990
  445   1HB   ALA  60          HB1       ALA  60  13.065 -11.057  22.671
  446   2HB   ALA  60          HB2       ALA  60  11.801 -11.599  23.774
  447   3HB   ALA  60          HB3       ALA  60  11.462 -10.325  22.605
  448    H    THR  61           HN       THR  61   9.669 -10.747  21.043
  449    HA   THR  61           HA       THR  61   7.610 -12.133  22.535
  450    HB   THR  61           HB       THR  61   6.114 -10.305  21.655
  451    HG1  THR  61           HG1      THR  61   8.592  -9.286  20.662
  452   1HG2  THR  61          HG21      THR  61   8.612  -9.392  23.084
  453   2HG2  THR  61          HG22      THR  61   7.219 -10.158  23.847
  454   3HG2  THR  61          HG23      THR  61   7.047  -8.575  23.088
  455    H    GLY  62           HN       GLY  62   8.614 -11.845  19.209
  456   1HA   GLY  62          HA2       GLY  62   7.933 -13.124  17.398
  457   2HA   GLY  62          HA1       GLY  62   6.698 -13.856  18.414
  458    H    HIS  63           HN       HIS  63   7.313 -10.451  17.621
  459    HA   HIS  63           HA       HIS  63   4.584 -10.331  16.513
  460   1HB   HIS  63          HB2       HIS  63   6.151  -8.169  17.939
  461   2HB   HIS  63          HB1       HIS  63   4.599  -7.913  17.144
  462    HD2  HIS  63           HD2      HIS  63   3.368 -10.823  18.376
  463    HE1  HIS  63           HE1      HIS  63   3.798  -8.708  22.006
  464    HE2  HIS  63           HE2      HIS  63   2.528 -10.544  20.808
  465    HA   PRO  64           HA       PRO  64   7.389  -9.655  13.048
  466   1HB   PRO  64          HB2       PRO  64   5.782 -10.631  11.125
  467   2HB   PRO  64          HB1       PRO  64   6.644 -11.681  12.255
  468   1HG   PRO  64          HG2       PRO  64   3.783 -10.809  12.284
  469   2HG   PRO  64          HG1       PRO  64   4.470 -12.407  12.627
  470   1HD   PRO  64          HD2       PRO  64   3.713 -10.619  14.562
  471   2HD   PRO  64          HD1       PRO  64   4.955 -11.864  14.796
  472    H    ILE  65           HN       ILE  65   4.198  -8.314  13.500
  473    HA   ILE  65           HA       ILE  65   4.653  -6.560  11.192
  474    HB   ILE  65           HB       ILE  65   2.074  -7.185  12.619
  475   1HG1  ILE  65          HG12      ILE  65   3.092  -7.693   9.816
  476   2HG1  ILE  65          HG11      ILE  65   2.807  -8.900  11.063
  477   1HG2  ILE  65          HG21      ILE  65   2.614  -5.193  10.414
  478   2HG2  ILE  65          HG22      ILE  65   2.073  -4.831  12.054
  479   3HG2  ILE  65          HG23      ILE  65   1.010  -5.701  10.947
  480   1HD1  ILE  65          HD11      ILE  65   0.423  -8.434  10.980
  481   2HD1  ILE  65          HD12      ILE  65   1.042  -8.894   9.393
  482   3HD1  ILE  65          HD13      ILE  65   0.702  -7.200   9.751
  483    H    ILE  66           HN       ILE  66   5.207  -4.609  11.441
  484    HA   ILE  66           HA       ILE  66   4.624  -3.177  13.941
  485    HB   ILE  66           HB       ILE  66   6.873  -2.063  13.641
  486   1HG1  ILE  66          HG12      ILE  66   7.269  -4.402  11.762
  487   2HG1  ILE  66          HG11      ILE  66   7.253  -2.701  11.314
  488   1HG2  ILE  66          HG21      ILE  66   8.116  -3.886  14.717
  489   2HG2  ILE  66          HG22      ILE  66   6.854  -5.022  14.237
  490   3HG2  ILE  66          HG23      ILE  66   6.490  -3.726  15.378
  491   1HD1  ILE  66          HD11      ILE  66   9.287  -4.051  13.065
  492   2HD1  ILE  66          HD12      ILE  66   9.272  -2.342  12.628
  493   3HD1  ILE  66          HD13      ILE  66   9.506  -3.569  11.382
  494    H    GLU  67           HN       GLU  67   4.724  -0.829  13.662
  495    HA   GLU  67           HA       GLU  67   4.238   0.037  10.894
  496   1HB   GLU  67          HB2       GLU  67   2.097  -0.154  12.014
  497   2HB   GLU  67          HB1       GLU  67   2.688   0.770  13.386
  498   1HG   GLU  67          HG2       GLU  67   2.820   2.762  12.054
  499   2HG   GLU  67          HG1       GLU  67   2.409   1.858  10.596
  500    H    GLY  68           HN       GLY  68   4.882   2.157  10.406
  501   1HA   GLY  68          HA2       GLY  68   7.149   3.123  11.815
  502   2HA   GLY  68          HA1       GLY  68   6.310   3.957  10.514
  503    H    TYR  69           HN       TYR  69   6.970   3.906  13.814
  504    HA   TYR  69           HA       TYR  69   4.597   5.361  14.628
  505   1HB   TYR  69          HB2       TYR  69   5.658   3.663  16.107
  506   2HB   TYR  69          HB1       TYR  69   7.086   4.685  16.212
  507    HD1  TYR  69           HD1      TYR  69   7.178   6.498  17.733
  508    HD2  TYR  69           HD2      TYR  69   3.489   4.489  17.067
  509    HE1  TYR  69           HE1      TYR  69   6.193   7.681  19.648
  510    HE2  TYR  69           HE2      TYR  69   2.493   5.669  18.980
  511    HH   TYR  69           HH       TYR  69   3.472   6.765  21.175
  512    H    ASP  70           HN       ASP  70   8.057   5.967  14.179
  513    HA   ASP  70           HA       ASP  70   7.779   8.721  14.958
  514   1HB   ASP  70          HB2       ASP  70  10.093   8.907  14.853
  515   2HB   ASP  70          HB1       ASP  70   9.871   7.212  15.245
  516    HA   PRO  71           HA       PRO  71   7.904   9.562  10.299
  517   1HB   PRO  71          HB2       PRO  71   7.545   7.330   8.631
  518   2HB   PRO  71          HB1       PRO  71   9.066   8.162   8.949
  519   1HG   PRO  71          HG2       PRO  71   8.403   5.536   9.704
  520   2HG   PRO  71          HG1       PRO  71   9.801   6.473  10.257
  521   1HD   PRO  71          HD2       PRO  71   7.190   5.986  11.603
  522   2HD   PRO  71          HD1       PRO  71   8.806   6.201  12.308
  523    HA   PRO  72           HA       PRO  72   3.409   9.330  10.567
  524   1HB   PRO  72          HB2       PRO  72   3.433  11.833   9.069
  525   2HB   PRO  72          HB1       PRO  72   2.917  11.531  10.730
  526   1HG   PRO  72          HG2       PRO  72   5.142  12.947  10.131
  527   2HG   PRO  72          HG1       PRO  72   5.001  11.956  11.595
  528   1HD   PRO  72          HD2       PRO  72   6.377  11.328   9.007
  529   2HD   PRO  72          HD1       PRO  72   6.924  11.036  10.673
  530    H    GLU  73           HN       GLU  73   4.970   8.154   8.249
  531    HA   GLU  73           HA       GLU  73   3.455   8.857   5.898
  532   1HB   GLU  73          HB2       GLU  73   5.434   6.645   6.446
  533   2HB   GLU  73          HB1       GLU  73   4.697   6.932   4.876
  534   1HG   GLU  73          HG2       GLU  73   6.425   8.879   6.381
  535   2HG   GLU  73          HG1       GLU  73   6.955   7.856   5.047
  536    H    GLY  74           HN       GLY  74   3.317   6.474   8.424
  537   1HA   GLY  74          HA2       GLY  74   1.626   5.014   8.992
  538   2HA   GLY  74          HA1       GLY  74   0.667   5.704   7.691
  539    H    TRP  75           HN       TRP  75   3.436   3.541   8.236
  540    HA   TRP  75           HA       TRP  75   2.346   1.798   6.147
  541   1HB   TRP  75          HB2       TRP  75   4.701   1.267   5.444
  542   2HB   TRP  75          HB1       TRP  75   4.170   2.896   5.048
  543    HD1  TRP  75           HD1      TRP  75   5.451   4.896   6.135
  544    HE1  TRP  75           HE1      TRP  75   7.620   5.084   7.506
  545    HE3  TRP  75           HE3      TRP  75   6.125  -0.044   7.263
  546    HZ2  TRP  75           HZ2      TRP  75   9.383   3.364   8.881
  547    HZ3  TRP  75           HZ3      TRP  75   8.082  -0.687   8.608
  548    HH2  TRP  75           HH2      TRP  75   9.677   0.981   9.399
  549    H    GLY  76           HN       GLY  76   2.831  -0.406   6.369
  550   1HA   GLY  76          HA2       GLY  76   3.684  -1.156   9.094
  551   2HA   GLY  76          HA1       GLY  76   2.410  -1.989   8.213
  552    H    TRP  77           HN       TRP  77   5.155  -2.694   9.338
  553    HA   TRP  77           HA       TRP  77   6.246  -3.938   6.897
  554   1HB   TRP  77          HB2       TRP  77   7.787  -2.299   7.879
  555   2HB   TRP  77          HB1       TRP  77   7.682  -3.109   9.435
  556    HD1  TRP  77           HD1      TRP  77   9.352  -5.054   9.871
  557    HE1  TRP  77           HE1      TRP  77  11.206  -6.185   8.483
  558    HE3  TRP  77           HE3      TRP  77   8.323  -2.981   5.314
  559    HZ2  TRP  77           HZ2      TRP  77  12.101  -6.195   5.806
  560    HZ3  TRP  77           HZ3      TRP  77   9.726  -3.602   3.391
  561    HH2  TRP  77           HH2      TRP  77  11.576  -5.176   3.634
  562    H    CYS  78           HN       CYS  78   6.447  -6.117   6.889
  563    HA   CYS  78           HA       CYS  78   5.826  -7.521   9.409
  564   1HB   CYS  78          HB2       CYS  78   4.167  -7.702   7.448
  565   2HB   CYS  78          HB1       CYS  78   5.399  -8.668   6.652
  566    H    TYR  79           HN       TYR  79   7.713  -8.160  10.222
  567    HA   TYR  79           HA       TYR  79  10.159  -8.290   9.021
  568   1HB   TYR  79          HB2       TYR  79   9.062  -9.829  11.357
  569   2HB   TYR  79          HB1       TYR  79  10.734 -10.009  10.849
  570    HD1  TYR  79           HD1      TYR  79  12.173  -7.880  10.781
  571    HD2  TYR  79           HD2      TYR  79   8.452  -8.110  12.829
  572    HE1  TYR  79           HE1      TYR  79  12.832  -5.968  12.179
  573    HE2  TYR  79           HE2      TYR  79   9.096  -6.191  14.224
  574    HH   TYR  79           HH       TYR  79  11.165  -5.099  15.001
  575    H    VAL  80           HN       VAL  80   7.999 -11.081   9.471
  576    HA   VAL  80           HA       VAL  80   9.817 -12.929   8.323
  577    HB   VAL  80           HB       VAL  80   7.925 -14.532   8.390
  578   1HG1  VAL  80          HG11      VAL  80   7.710 -14.545  10.834
  579   2HG1  VAL  80          HG12      VAL  80   8.348 -12.902  10.894
  580   3HG1  VAL  80          HG13      VAL  80   9.368 -14.223  10.325
  581   1HG2  VAL  80          HG21      VAL  80   6.094 -12.995   7.910
  582   2HG2  VAL  80          HG22      VAL  80   6.372 -12.166   9.441
  583   3HG2  VAL  80          HG23      VAL  80   5.815 -13.839   9.434
  584    H    ASP  81           HN       ASP  81   7.530 -10.797   6.913
  585    HA   ASP  81           HA       ASP  81   7.419 -12.360   4.433
  586   1HB   ASP  81          HB2       ASP  81   5.919  -9.883   5.307
  587   2HB   ASP  81          HB1       ASP  81   5.797 -10.575   3.695
  588    H    GLU  82           HN       GLU  82   8.636  -9.403   5.802
  589    HA   GLU  82           HA       GLU  82  10.014  -7.775   5.082
  590   1HB   GLU  82          HB2       GLU  82  10.748  -9.918   3.104
  591   2HB   GLU  82          HB1       GLU  82  11.486  -8.321   3.046
  592   1HG   GLU  82          HG2       GLU  82  12.213  -8.627   5.393
  593   2HG   GLU  82          HG1       GLU  82  11.582 -10.271   5.334
  594    H    VAL  83           HN       VAL  83   7.251  -8.063   4.088
  595    HA   VAL  83           HA       VAL  83   7.485  -6.333   1.728
  596    HB   VAL  83           HB       VAL  83   5.107  -6.770   1.290
  597   1HG1  VAL  83          HG11      VAL  83   6.746  -9.282   1.593
  598   2HG1  VAL  83          HG12      VAL  83   6.766  -8.179   0.216
  599   3HG1  VAL  83          HG13      VAL  83   5.311  -9.106   0.582
  600   1HG2  VAL  83          HG21      VAL  83   3.898  -8.512   2.505
  601   2HG2  VAL  83          HG22      VAL  83   4.361  -7.191   3.579
  602   3HG2  VAL  83          HG23      VAL  83   5.267  -8.704   3.601
  603    H    MET  84           HN       MET  84   6.761  -4.289   1.801
  604    HA   MET  84           HA       MET  84   5.696  -3.340   4.374
  605   1HB   MET  84          HB2       MET  84   7.827  -2.323   3.628
  606   2HB   MET  84          HB1       MET  84   7.035  -1.772   2.159
  607   1HG   MET  84          HG2       MET  84   5.517  -0.394   3.510
  608   2HG   MET  84          HG1       MET  84   6.357  -0.922   4.966
  609   1HE   MET  84          HE1       MET  84   6.604   1.144   1.639
  610   2HE   MET  84          HE2       MET  84   7.880  -0.057   1.439
  611   3HE   MET  84          HE3       MET  84   8.297   1.643   1.653
  612    H    PHE  85           HN       PHE  85   3.682  -2.626   4.470
  613    HA   PHE  85           HA       PHE  85   2.326  -1.889   1.963
  614   1HB   PHE  85          HB2       PHE  85   0.220  -2.830   3.013
  615   2HB   PHE  85          HB1       PHE  85   1.420  -4.022   2.531
  616    HD1  PHE  85           HD1      PHE  85  -0.345  -2.489   5.320
  617    HD2  PHE  85           HD2      PHE  85   2.703  -5.243   4.210
  618    HE1  PHE  85           HE1      PHE  85  -0.386  -3.447   7.585
  619    HE2  PHE  85           HE2      PHE  85   2.667  -6.199   6.477
  620    HZ   PHE  85           HZ       PHE  85   1.127  -5.296   8.168
  621    H    ASP  86           HN       ASP  86   0.393  -0.463   2.371
  622    HA   ASP  86           HA       ASP  86   1.247   1.602   4.215
  623   1HB   ASP  86          HB2       ASP  86  -0.206   3.070   3.101
  624   2HB   ASP  86          HB1       ASP  86   0.365   2.004   1.825
  625    H    LEU  87           HN       LEU  87   0.171   2.313   5.985
  626    HA   LEU  87           HA       LEU  87  -2.225   0.816   6.806
  627   1HB   LEU  87          HB2       LEU  87   0.296   1.311   8.348
  628   2HB   LEU  87          HB1       LEU  87  -1.229   1.148   9.194
  629    HG   LEU  87           HG       LEU  87   0.017  -0.943   7.408
  630   1HD1  LEU  87          HD11      LEU  87   1.218  -0.672   9.507
  631   2HD1  LEU  87          HD12      LEU  87   0.313  -2.186   9.503
  632   3HD1  LEU  87          HD13      LEU  87  -0.294  -0.799  10.406
  633   1HD2  LEU  87          HD21      LEU  87  -1.781  -2.385   8.241
  634   2HD2  LEU  87          HD22      LEU  87  -2.415  -1.012   7.334
  635   3HD2  LEU  87          HD23      LEU  87  -2.482  -1.012   9.096
  636    H    SER  88           HN       SER  88  -1.350   3.668   5.807
  637    HA   SER  88           HA       SER  88  -1.743   5.517   7.854
  638   1HB   SER  88          HB2       SER  88  -0.833   6.052   5.605
  639   2HB   SER  88          HB1       SER  88  -2.452   5.870   4.931
  640    HG   SER  88           HG       SER  88  -2.692   7.534   6.948
  641    H    ASP  89           HN       ASP  89  -4.039   3.594   6.147
  642    HA   ASP  89           HA       ASP  89  -6.379   5.117   6.623
  643   1HB   ASP  89          HB2       ASP  89  -6.362   3.394   4.934
  644   2HB   ASP  89          HB1       ASP  89  -5.944   2.165   6.121
  645    H    ARG  90           HN       ARG  90  -4.436   3.148   8.667
  646    HA   ARG  90           HA       ARG  90  -6.429   3.325  10.829
  647   1HB   ARG  90          HB2       ARG  90  -4.813   0.819  10.380
  648   2HB   ARG  90          HB1       ARG  90  -6.210   1.039  11.421
  649   1HG   ARG  90          HG2       ARG  90  -7.699   1.018   9.609
  650   2HG   ARG  90          HG1       ARG  90  -6.402   1.251   8.436
  651   1HD   ARG  90          HD2       ARG  90  -5.495  -0.992   9.262
  652   2HD   ARG  90          HD1       ARG  90  -7.070  -1.208  10.026
  653    HE   ARG  90           HE       ARG  90  -8.070  -1.123   7.824
  654   1HH1  ARG  90          HH11      ARG  90  -4.603  -1.522   7.951
  655   2HH1  ARG  90          HH12      ARG  90  -4.469  -2.168   6.346
  656   1HH2  ARG  90          HH21      ARG  90  -7.928  -1.999   5.703
  657   2HH2  ARG  90          HH22      ARG  90  -6.368  -2.435   5.060
  658    H    MET  91           HN       MET  91  -3.807   4.636  10.083
  659    HA   MET  91           HA       MET  91  -1.676   3.330  11.376
  660   1HB   MET  91          HB2       MET  91  -0.354   5.281  10.903
  661   2HB   MET  91          HB1       MET  91  -1.382   4.932   9.522
  662   1HG   MET  91          HG2       MET  91  -2.861   6.726  10.090
  663   2HG   MET  91          HG1       MET  91  -2.005   7.008  11.606
  664   1HE   MET  91          HE1       MET  91   1.485   8.268  10.295
  665   2HE   MET  91          HE2       MET  91   1.018   6.605  10.653
  666   3HE   MET  91          HE3       MET  91   0.517   7.913  11.726
  667    H    THR  92           HN       THR  92  -0.551   3.727  13.221
  668    HA   THR  92           HA       THR  92  -1.984   5.191  15.324
  669    HB   THR  92           HB       THR  92   0.445   3.440  15.704
  670    HG1  THR  92           HG1      THR  92  -1.104   2.161  14.674
  671   1HG2  THR  92          HG21      THR  92  -0.218   4.866  17.584
  672   2HG2  THR  92          HG22      THR  92  -0.479   3.162  17.956
  673   3HG2  THR  92          HG23      THR  92  -1.846   4.190  17.526
  674    HA   PRO  93           HA       PRO  93   1.236   8.223  14.342
  675   1HB   PRO  93          HB2       PRO  93  -0.066  10.383  15.266
  676   2HB   PRO  93          HB1       PRO  93  -0.488   9.626  13.726
  677   1HG   PRO  93          HG2       PRO  93  -1.834   9.396  16.385
  678   2HG   PRO  93          HG1       PRO  93  -2.555   9.532  14.771
  679   1HD   PRO  93          HD2       PRO  93  -2.267   7.169  16.152
  680   2HD   PRO  93          HD1       PRO  93  -2.400   7.288  14.387
  681    H    HIS  94           HN       HIS  94   2.654   9.550  15.591
  682    HA   HIS  94           HA       HIS  94   2.983   8.631  18.285
  683   1HB   HIS  94          HB2       HIS  94   4.867  10.377  18.327
  684   2HB   HIS  94          HB1       HIS  94   5.043   9.002  17.250
  685    HD1  HIS  94           HD1      HIS  94   5.284   9.467  14.787
  686    HD2  HIS  94           HD2      HIS  94   4.392  12.875  17.003
  687    HE1  HIS  94           HE1      HIS  94   5.639  11.406  13.223
  688    HE2  HIS  94           HE2      HIS  94   5.318  13.459  14.652
  689    H    ASN  95           HN       ASN  95   1.842   9.320  19.891
  690    HA   ASN  95           HA       ASN  95   0.246  11.703  19.631
  691   1HB   ASN  95          HB2       ASN  95  -0.820  10.982  21.708
  692   2HB   ASN  95          HB1       ASN  95  -0.714   9.643  20.571
  693   1HD2  ASN  95          HD21      ASN  95   0.641   7.911  21.034
  694   2HD2  ASN  95          HD22      ASN  95   1.347   7.672  22.601
  695    H    GLY  96           HN       GLY  96   3.221  10.877  21.130
  696   1HA   GLY  96          HA2       GLY  96   3.050  13.255  22.860
  697   2HA   GLY  96          HA1       GLY  96   4.117  11.891  23.138
  698    HA   PRO  97           HA       PRO  97   6.234  15.305  20.608
  699   1HB   PRO  97          HB2       PRO  97   7.441  16.343  23.040
  700   2HB   PRO  97          HB1       PRO  97   6.471  17.194  21.837
  701   1HG   PRO  97          HG2       PRO  97   5.605  16.685  24.369
  702   2HG   PRO  97          HG1       PRO  97   4.517  16.848  22.980
  703   1HD   PRO  97          HD2       PRO  97   5.511  14.367  24.331
  704   2HD   PRO  97          HD1       PRO  97   3.893  14.733  23.693
  705    H    ILE  98           HN       ILE  98   7.537  13.695  19.818
  706    HA   ILE  98           HA       ILE  98   9.430  12.317  21.498
  707    HB   ILE  98           HB       ILE  98   9.126  12.274  18.491
  708   1HG1  ILE  98          HG12      ILE  98   8.088  10.364  20.596
  709   2HG1  ILE  98          HG11      ILE  98   7.110  11.494  19.663
  710   1HG2  ILE  98          HG21      ILE  98  10.406  10.187  18.595
  711   2HG2  ILE  98          HG22      ILE  98  10.627  10.414  20.329
  712   3HG2  ILE  98          HG23      ILE  98  11.341  11.558  19.193
  713   1HD1  ILE  98          HD11      ILE  98   6.930   9.241  18.788
  714   2HD1  ILE  98          HD12      ILE  98   8.677   9.178  18.550
  715   3HD1  ILE  98          HD13      ILE  98   7.698  10.309  17.614
  716    HA   PRO  99           HA       PRO  99  12.660  15.412  21.038
  717   1HB   PRO  99          HB2       PRO  99  14.326  13.127  21.941
  718   2HB   PRO  99          HB1       PRO  99  14.199  14.758  22.609
  719   1HG   PRO  99          HG2       PRO  99  13.101  12.676  23.863
  720   2HG   PRO  99          HG1       PRO  99  12.294  14.255  23.828
  721   1HD   PRO  99          HD2       PRO  99  11.709  11.789  22.237
  722   2HD   PRO  99          HD1       PRO  99  10.585  12.962  22.957
  723    H    ARG 100           HN       ARG 100  13.373  15.825  19.055
  724    HA   ARG 100           HA       ARG 100  13.947  13.696  17.186
  725   1HB   ARG 100          HB2       ARG 100  12.763  15.782  16.519
  726   2HB   ARG 100          HB1       ARG 100  14.226  16.693  16.862
  727   1HG   ARG 100          HG2       ARG 100  14.157  16.396  14.529
  728   2HG   ARG 100          HG1       ARG 100  15.379  15.274  15.129
  729   1HD   ARG 100          HD2       ARG 100  13.786  13.441  15.000
  730   2HD   ARG 100          HD1       ARG 100  12.524  14.553  14.469
  731    HE   ARG 100           HE       ARG 100  14.968  14.254  12.855
  732   1HH1  ARG 100          HH11      ARG 100  11.499  13.866  13.222
  733   2HH1  ARG 100          HH12      ARG 100  11.237  13.500  11.539
  734   1HH2  ARG 100          HH21      ARG 100  14.614  13.777  10.636
  735   2HH2  ARG 100          HH22      ARG 100  13.003  13.465  10.074
  736    H    TYR 101           HN       TYR 101  15.840  12.660  17.477
  737    HA   TYR 101           HA       TYR 101  18.186  14.120  18.373
  738   1HB   TYR 101          HB2       TYR 101  17.757  11.201  17.718
  739   2HB   TYR 101          HB1       TYR 101  19.295  11.870  18.251
  740    HD1  TYR 101           HD1      TYR 101  19.419  12.927  20.549
  741    HD2  TYR 101           HD2      TYR 101  16.092  10.604  19.273
  742    HE1  TYR 101           HE1      TYR 101  18.760  12.594  22.895
  743    HE2  TYR 101           HE2      TYR 101  15.422  10.269  21.614
  744    HH   TYR 101           HH       TYR 101  16.563  10.269  23.870
  745    H    VAL 102           HN       VAL 102  16.778  13.042  15.446
  746    HA   VAL 102           HA       VAL 102  19.265  13.629  14.000
  747    HB   VAL 102           HB       VAL 102  18.106  12.450  12.053
  748   1HG1  VAL 102          HG11      VAL 102  18.787  10.844  14.515
  749   2HG1  VAL 102          HG12      VAL 102  19.944  11.480  13.346
  750   3HG1  VAL 102          HG13      VAL 102  18.782  10.248  12.855
  751   1HG2  VAL 102          HG21      VAL 102  15.828  12.459  12.937
  752   2HG2  VAL 102          HG22      VAL 102  16.340  11.457  14.295
  753   3HG2  VAL 102          HG23      VAL 102  16.381  10.807  12.656
  Start of MODEL    3
    1   1H    MET   1          HT1       MET   1   6.064   1.122  -0.682
    2   2H    MET   1          HT2       MET   1   5.010   2.062   0.255
    3   3H    MET   1          HT3       MET   1   4.686   1.812  -1.392
    4    HA   MET   1           HA       MET   1   4.673  -0.254   0.730
    5   1HB   MET   1          HB2       MET   1   2.709   1.145   0.872
    6   2HB   MET   1          HB1       MET   1   2.464   1.060  -0.867
    7   1HG   MET   1          HG2       MET   1   1.950  -1.301  -0.707
    8   2HG   MET   1          HG1       MET   1   2.272  -1.273   1.025
    9   1HE   MET   1          HE1       MET   1   0.440   1.526  -1.061
   10   2HE   MET   1          HE2       MET   1  -1.238   0.994  -0.949
   11   3HE   MET   1          HE3       MET   1  -0.067   0.034  -1.853
   12    H    THR   2           HN       THR   2   4.861  -2.307   0.039
   13    HA   THR   2           HA       THR   2   4.872  -2.727  -2.863
   14    HB   THR   2           HB       THR   2   6.950  -3.432  -2.047
   15    HG1  THR   2           HG1      THR   2   5.952  -5.006  -3.401
   16   1HG2  THR   2          HG21      THR   2   6.339  -3.457   0.359
   17   2HG2  THR   2          HG22      THR   2   7.338  -4.825  -0.130
   18   3HG2  THR   2          HG23      THR   2   5.608  -5.044   0.118
   19    H    MET   3           HN       MET   3   3.903  -4.576   0.060
   20    HA   MET   3           HA       MET   3   1.328  -5.173  -1.048
   21   1HB   MET   3          HB2       MET   3   3.488  -7.259  -1.034
   22   2HB   MET   3          HB1       MET   3   1.819  -7.731  -0.762
   23   1HG   MET   3          HG2       MET   3   2.880  -6.308  -3.192
   24   2HG   MET   3          HG1       MET   3   2.459  -8.017  -3.086
   25   1HE   MET   3          HE1       MET   3  -0.365  -6.519  -5.371
   26   2HE   MET   3          HE2       MET   3   0.918  -7.723  -5.244
   27   3HE   MET   3          HE3       MET   3   1.323  -6.009  -5.317
   28    H    GLY   4           HN       GLY   4  -0.058  -6.215   0.465
   29   1HA   GLY   4          HA2       GLY   4   0.908  -6.165   3.230
   30   2HA   GLY   4          HA1       GLY   4  -0.772  -6.291   2.717
   31    H    CYS   5           HN       CYS   5  -0.927  -8.111   4.242
   32    HA   CYS   5           HA       CYS   5  -0.570 -10.589   2.910
   33   1HB   CYS   5          HB2       CYS   5   1.048 -11.654   4.350
   34   2HB   CYS   5          HB1       CYS   5   1.766 -10.204   3.658
   35    H    ARG   6           HN       ARG   6  -1.183 -12.452   4.286
   36    HA   ARG   6           HA       ARG   6  -3.656 -12.137   5.463
   37   1HB   ARG   6          HB2       ARG   6  -3.337 -14.429   6.340
   38   2HB   ARG   6          HB1       ARG   6  -2.854 -14.275   4.655
   39   1HG   ARG   6          HG2       ARG   6  -0.499 -14.081   5.393
   40   2HG   ARG   6          HG1       ARG   6  -1.031 -14.368   7.050
   41   1HD   ARG   6          HD2       ARG   6  -1.405 -16.258   4.731
   42   2HD   ARG   6          HD1       ARG   6  -0.168 -16.402   5.978
   43    HE   ARG   6           HE       ARG   6  -2.923 -16.335   6.912
   44   1HH1  ARG   6          HH11      ARG   6  -0.118 -18.271   6.084
   45   2HH1  ARG   6          HH12      ARG   6  -0.711 -19.697   6.879
   46   1HH2  ARG   6          HH21      ARG   6  -3.710 -18.199   7.946
   47   2HH2  ARG   6          HH22      ARG   6  -2.763 -19.659   7.941
   48    H    HIS   7           HN       HIS   7  -0.520 -11.895   6.959
   49    HA   HIS   7           HA       HIS   7  -1.233 -12.272   9.641
   50   1HB   HIS   7          HB2       HIS   7   1.011 -10.606   8.487
   51   2HB   HIS   7          HB1       HIS   7   0.866 -11.066  10.179
   52    HD2  HIS   7           HD2      HIS   7   0.217 -14.232   9.792
   53    HE1  HIS   7           HE1      HIS   7   3.852 -14.224   7.629
   54    HE2  HIS   7           HE2      HIS   7   2.051 -15.681   8.657
   55    H    VAL   8           HN       VAL   8  -1.751  -9.598   7.535
   56    HA   VAL   8           HA       VAL   8  -1.767  -7.494   9.394
   57    HB   VAL   8           HB       VAL   8  -1.959  -7.559   6.718
   58   1HG1  VAL   8          HG11      VAL   8  -4.294  -8.349   6.760
   59   2HG1  VAL   8          HG12      VAL   8  -4.109  -6.789   5.957
   60   3HG1  VAL   8          HG13      VAL   8  -4.748  -6.864   7.600
   61   1HG2  VAL   8          HG21      VAL   8  -2.430  -5.161   6.805
   62   2HG2  VAL   8          HG22      VAL   8  -1.280  -5.649   8.050
   63   3HG2  VAL   8          HG23      VAL   8  -2.961  -5.330   8.478
   64    H    ALA   9           HN       ALA   9  -4.124  -9.962   8.694
   65    HA   ALA   9           HA       ALA   9  -6.302  -8.592   9.982
   66   1HB   ALA   9          HB1       ALA   9  -7.520 -10.682   9.704
   67   2HB   ALA   9          HB2       ALA   9  -6.033 -11.494   9.216
   68   3HB   ALA   9          HB3       ALA   9  -6.713 -10.218   8.207
   69    H    GLY  10           HN       GLY  10  -3.546  -9.923  11.189
   70   1HA   GLY  10          HA2       GLY  10  -4.836 -10.906  13.646
   71   2HA   GLY  10          HA1       GLY  10  -3.174 -11.223  13.170
   72    H    ILE  11           HN       ILE  11  -3.553  -8.098  12.438
   73    HA   ILE  11           HA       ILE  11  -2.492  -7.233  15.034
   74    HB   ILE  11           HB       ILE  11  -1.667  -5.234  13.862
   75   1HG1  ILE  11          HG12      ILE  11  -2.801  -6.591  11.408
   76   2HG1  ILE  11          HG11      ILE  11  -3.358  -5.081  12.113
   77   1HG2  ILE  11          HG21      ILE  11   0.065  -6.368  12.509
   78   2HG2  ILE  11          HG22      ILE  11  -0.859  -7.865  12.639
   79   3HG2  ILE  11          HG23      ILE  11  -0.187  -7.114  14.087
   80   1HD1  ILE  11          HD11      ILE  11  -2.005  -4.798  10.077
   81   2HD1  ILE  11          HD12      ILE  11  -0.628  -5.503  10.929
   82   3HD1  ILE  11          HD13      ILE  11  -1.324  -3.981  11.488
   83    H    ARG  12           HN       ARG  12  -3.216  -5.270  15.972
   84    HA   ARG  12           HA       ARG  12  -5.797  -4.302  14.977
   85   1HB   ARG  12          HB2       ARG  12  -6.468  -3.973  17.409
   86   2HB   ARG  12          HB1       ARG  12  -6.480  -5.622  16.809
   87   1HG   ARG  12          HG2       ARG  12  -4.086  -4.568  18.256
   88   2HG   ARG  12          HG1       ARG  12  -5.506  -5.115  19.150
   89   1HD   ARG  12          HD2       ARG  12  -5.360  -7.283  17.957
   90   2HD   ARG  12          HD1       ARG  12  -3.876  -6.725  17.189
   91    HE   ARG  12           HE       ARG  12  -3.564  -6.481  19.954
   92   1HH1  ARG  12          HH11      ARG  12  -3.944  -8.982  17.533
   93   2HH1  ARG  12          HH12      ARG  12  -3.070 -10.175  18.444
   94   1HH2  ARG  12          HH21      ARG  12  -2.415  -8.045  21.157
   95   2HH2  ARG  12          HH22      ARG  12  -2.195  -9.643  20.500
   96    H    THR  13           HN       THR  13  -6.359  -2.143  15.981
   97    HA   THR  13           HA       THR  13  -4.037  -0.443  15.757
   98    HB   THR  13           HB       THR  13  -6.847   0.425  16.446
   99    HG1  THR  13           HG1      THR  13  -7.372   0.182  14.382
  100   1HG2  THR  13          HG21      THR  13  -4.547   1.825  15.072
  101   2HG2  THR  13          HG22      THR  13  -5.083   2.108  16.729
  102   3HG2  THR  13          HG23      THR  13  -6.141   2.516  15.378
  103    H    VAL  14           HN       VAL  14  -2.740  -0.388  17.428
  104    HA   VAL  14           HA       VAL  14  -3.776  -0.769  20.118
  105    HB   VAL  14           HB       VAL  14  -1.404  -1.056  20.753
  106   1HG1  VAL  14          HG11      VAL  14  -2.715  -2.986  20.037
  107   2HG1  VAL  14          HG12      VAL  14  -1.021  -3.155  19.574
  108   3HG1  VAL  14          HG13      VAL  14  -2.225  -2.704  18.367
  109   1HG2  VAL  14          HG21      VAL  14   0.331  -1.123  19.035
  110   2HG2  VAL  14          HG22      VAL  14  -0.416   0.473  19.110
  111   3HG2  VAL  14          HG23      VAL  14  -0.848  -0.644  17.814
  112    H    THR  15           HN       THR  15  -2.286   0.480  21.797
  113    HA   THR  15           HA       THR  15  -2.336   3.331  21.060
  114    HB   THR  15           HB       THR  15  -2.693   2.126  23.821
  115    HG1  THR  15           HG1      THR  15  -4.627   3.205  22.006
  116   1HG2  THR  15          HG21      THR  15  -1.778   4.399  23.852
  117   2HG2  THR  15          HG22      THR  15  -3.435   4.375  24.457
  118   3HG2  THR  15          HG23      THR  15  -3.101   4.950  22.824
  119    HA   PRO  16           HA       PRO  16   2.069   3.232  21.619
  120   1HB   PRO  16          HB2       PRO  16   1.800   6.066  22.426
  121   2HB   PRO  16          HB1       PRO  16   2.740   5.354  21.110
  122   1HG   PRO  16          HG2       PRO  16   0.506   6.736  20.623
  123   2HG   PRO  16          HG1       PRO  16   0.935   5.305  19.668
  124   1HD   PRO  16          HD2       PRO  16  -1.067   5.583  21.873
  125   2HD   PRO  16          HD1       PRO  16  -1.175   4.659  20.360
  126    H    SER  17           HN       SER  17   2.965   2.318  23.331
  127    HA   SER  17           HA       SER  17   2.172   2.869  26.014
  128   1HB   SER  17          HB2       SER  17   2.964   0.649  25.306
  129   2HB   SER  17          HB1       SER  17   4.547   1.326  24.936
  130    HG   SER  17           HG       SER  17   4.947   0.742  26.914
  131    H    ALA  18           HN       ALA  18   4.585   4.107  23.863
  132    HA   ALA  18           HA       ALA  18   5.392   6.052  25.868
  133   1HB   ALA  18          HB1       ALA  18   7.386   4.303  24.426
  134   2HB   ALA  18          HB2       ALA  18   7.033   4.280  26.155
  135   3HB   ALA  18          HB3       ALA  18   7.786   5.699  25.426
  136    H    LEU  19           HN       LEU  19   6.881   7.724  24.822
  137    HA   LEU  19           HA       LEU  19   5.802   8.423  22.202
  138   1HB   LEU  19          HB2       LEU  19   7.508   9.901  24.199
  139   2HB   LEU  19          HB1       LEU  19   7.231  10.519  22.585
  140    HG   LEU  19           HG       LEU  19   4.770  10.517  23.086
  141   1HD1  LEU  19          HD11      LEU  19   5.711   9.986  25.900
  142   2HD1  LEU  19          HD12      LEU  19   4.747   8.899  24.901
  143   3HD1  LEU  19          HD13      LEU  19   4.074  10.442  25.426
  144   1HD2  LEU  19          HD21      LEU  19   4.858  12.547  24.435
  145   2HD2  LEU  19          HD22      LEU  19   6.118  12.542  23.201
  146   3HD2  LEU  19          HD23      LEU  19   6.526  12.185  24.879
  147    H    GLY  20           HN       GLY  20   8.927   7.879  23.755
  148   1HA   GLY  20          HA2       GLY  20  10.170   7.630  21.104
  149   2HA   GLY  20          HA1       GLY  20  11.035   7.877  22.616
  150    H    CYS  21           HN       CYS  21  12.316   6.024  21.753
  151    HA   CYS  21           HA       CYS  21  11.217   3.436  21.582
  152   1HB   CYS  21          HB2       CYS  21  13.426   3.978  20.669
  153   2HB   CYS  21          HB1       CYS  21  14.036   4.274  22.293
  154    HG   CYS  21           HG       CYS  21  15.143   1.900  21.818
  155    H    GLU  22           HN       GLU  22  10.397   2.208  23.112
  156    HA   GLU  22           HA       GLU  22  10.106   3.104  25.748
  157   1HB   GLU  22          HB2       GLU  22   8.792   1.358  24.212
  158   2HB   GLU  22          HB1       GLU  22   9.749   0.215  25.142
  159   1HG   GLU  22          HG2       GLU  22   8.801   0.971  27.190
  160   2HG   GLU  22          HG1       GLU  22   8.008   2.326  26.386
  161    H    GLU  23           HN       GLU  23  12.628   1.299  24.284
  162    HA   GLU  23           HA       GLU  23  13.657   0.342  26.836
  163   1HB   GLU  23          HB2       GLU  23  13.881  -1.149  24.925
  164   2HB   GLU  23          HB1       GLU  23  14.745   0.091  24.025
  165   1HG   GLU  23          HG2       GLU  23  16.547   0.010  25.705
  166   2HG   GLU  23          HG1       GLU  23  15.694  -1.301  26.518
  167    H    CYS  24           HN       CYS  24  14.764   2.421  24.168
  168    HA   CYS  24           HA       CYS  24  17.175   3.200  25.310
  169   1HB   CYS  24          HB2       CYS  24  15.459   4.720  23.342
  170   2HB   CYS  24          HB1       CYS  24  17.165   5.022  23.660
  171    HG   CYS  24           HG       CYS  24  18.089   3.315  21.980
  172    H    LEU  25           HN       LEU  25  13.961   4.435  25.882
  173    HA   LEU  25           HA       LEU  25  14.591   6.994  26.827
  174   1HB   LEU  25          HB2       LEU  25  12.305   5.145  27.453
  175   2HB   LEU  25          HB1       LEU  25  12.405   6.773  28.096
  176    HG   LEU  25           HG       LEU  25  12.326   6.083  25.156
  177   1HD1  LEU  25          HD11      LEU  25  10.050   6.955  25.214
  178   2HD1  LEU  25          HD12      LEU  25  10.173   7.183  26.959
  179   3HD1  LEU  25          HD13      LEU  25  10.220   5.558  26.277
  180   1HD2  LEU  25          HD21      LEU  25  13.519   8.159  25.623
  181   2HD2  LEU  25          HD22      LEU  25  12.160   8.734  26.589
  182   3HD2  LEU  25          HD23      LEU  25  11.965   8.486  24.854
  183    H    LYS  26           HN       LYS  26  15.009   3.912  28.382
  184    HA   LYS  26           HA       LYS  26  14.867   4.868  31.062
  185   1HB   LYS  26          HB2       LYS  26  15.769   2.721  31.718
  186   2HB   LYS  26          HB1       LYS  26  14.559   2.486  30.466
  187   1HG   LYS  26          HG2       LYS  26  16.381   2.291  28.804
  188   2HG   LYS  26          HG1       LYS  26  17.545   2.403  30.124
  189   1HD   LYS  26          HD2       LYS  26  15.404   0.293  29.912
  190   2HD   LYS  26          HD1       LYS  26  17.073   0.075  29.384
  191   1HE   LYS  26          HE2       LYS  26  17.807   0.593  31.706
  192   2HE   LYS  26          HE1       LYS  26  16.111   0.630  32.188
  193   1HZ   LYS  26          HZ1       LYS  26  17.459  -1.715  30.962
  194   2HZ   LYS  26          HZ2       LYS  26  15.881  -1.666  31.577
  195   3HZ   LYS  26          HZ3       LYS  26  17.203  -1.519  32.627
  196    H    ILE  27           HN       ILE  27  17.430   4.732  28.685
  197    HA   ILE  27           HA       ILE  27  19.300   5.748  30.726
  198    HB   ILE  27           HB       ILE  27  21.137   5.044  29.214
  199   1HG1  ILE  27          HG12      ILE  27  18.909   3.710  27.657
  200   2HG1  ILE  27          HG11      ILE  27  19.913   5.041  27.097
  201   1HG2  ILE  27          HG21      ILE  27  20.477   3.643  31.077
  202   2HG2  ILE  27          HG22      ILE  27  20.972   2.651  29.706
  203   3HG2  ILE  27          HG23      ILE  27  19.261   2.852  30.076
  204   1HD1  ILE  27          HD11      ILE  27  21.876   3.595  27.181
  205   2HD1  ILE  27          HD12      ILE  27  20.623   2.933  26.130
  206   3HD1  ILE  27          HD13      ILE  27  20.869   2.261  27.742
  207    H    GLY  28           HN       GLY  28  17.470   6.637  28.079
  208   1HA   GLY  28          HA2       GLY  28  17.299   8.663  26.998
  209   2HA   GLY  28          HA1       GLY  28  18.609   9.258  28.009
  210    H    SER  29           HN       SER  29  18.662   6.479  25.825
  211    HA   SER  29           HA       SER  29  21.018   7.591  24.542
  212   1HB   SER  29          HB2       SER  29  21.148   5.350  23.449
  213   2HB   SER  29          HB1       SER  29  21.128   5.264  25.207
  214    HG   SER  29           HG       SER  29  19.363   4.267  23.392
  215    HA   PRO  30           HA       PRO  30  18.902   9.116  20.983
  216   1HB   PRO  30          HB2       PRO  30  20.882   8.896  19.126
  217   2HB   PRO  30          HB1       PRO  30  20.859  10.146  20.376
  218   1HG   PRO  30          HG2       PRO  30  22.359   7.555  20.314
  219   2HG   PRO  30          HG1       PRO  30  22.918   9.161  20.822
  220   1HD   PRO  30          HD2       PRO  30  22.181   7.269  22.599
  221   2HD   PRO  30          HD1       PRO  30  21.905   8.999  22.891
  222    H    TRP  31           HN       TRP  31  18.051   8.500  18.946
  223    HA   TRP  31           HA       TRP  31  18.540   5.783  18.027
  224   1HB   TRP  31          HB2       TRP  31  16.061   5.392  17.809
  225   2HB   TRP  31          HB1       TRP  31  16.657   5.416  19.464
  226    HD1  TRP  31           HD1      TRP  31  14.849   7.815  16.991
  227    HE1  TRP  31           HE1      TRP  31  13.306   9.342  18.373
  228    HE3  TRP  31           HE3      TRP  31  16.096   6.210  21.685
  229    HZ2  TRP  31           HZ2      TRP  31  12.689   9.797  21.085
  230    HZ3  TRP  31           HZ3      TRP  31  14.977   7.241  23.619
  231    HH2  TRP  31           HH2      TRP  31  13.309   8.997  23.322
  232    H    VAL  32           HN       VAL  32  17.622   5.407  15.867
  233    HA   VAL  32           HA       VAL  32  17.789   7.861  14.287
  234    HB   VAL  32           HB       VAL  32  17.776   4.991  13.334
  235   1HG1  VAL  32          HG11      VAL  32  18.677   5.945  11.249
  236   2HG1  VAL  32          HG12      VAL  32  18.465   7.564  11.915
  237   3HG1  VAL  32          HG13      VAL  32  17.058   6.543  11.614
  238   1HG2  VAL  32          HG21      VAL  32  20.087   6.869  13.813
  239   2HG2  VAL  32          HG22      VAL  32  20.201   5.289  13.037
  240   3HG2  VAL  32          HG23      VAL  32  19.716   5.409  14.729
  241    H    HIS  33           HN       HIS  33  15.717   4.981  14.590
  242    HA   HIS  33           HA       HIS  33  13.434   6.623  13.814
  243   1HB   HIS  33          HB2       HIS  33  14.288   4.100  12.407
  244   2HB   HIS  33          HB1       HIS  33  12.613   4.636  12.398
  245    HD1  HIS  33           HD1      HIS  33  12.375   7.275  11.493
  246    HD2  HIS  33           HD2      HIS  33  15.703   5.059  10.325
  247    HE1  HIS  33           HE1      HIS  33  13.269   8.414   9.439
  248    HE2  HIS  33           HE2      HIS  33  15.137   6.930   8.628
  249    H    LEU  34           HN       LEU  34  11.371   5.617  14.314
  250    HA   LEU  34           HA       LEU  34  11.558   3.692  16.541
  251   1HB   LEU  34          HB2       LEU  34   9.849   6.180  16.431
  252   2HB   LEU  34          HB1       LEU  34   9.769   4.958  17.683
  253    HG   LEU  34           HG       LEU  34  12.142   6.729  17.109
  254   1HD1  LEU  34          HD11      LEU  34  10.169   6.732  19.389
  255   2HD1  LEU  34          HD12      LEU  34  10.254   7.926  18.094
  256   3HD1  LEU  34          HD13      LEU  34  11.585   7.772  19.240
  257   1HD2  LEU  34          HD21      LEU  34  12.822   4.547  17.934
  258   2HD2  LEU  34          HD22      LEU  34  11.677   4.677  19.269
  259   3HD2  LEU  34          HD23      LEU  34  13.053   5.777  19.176
  260    H    ARG  35           HN       ARG  35  10.014   2.142  16.573
  261    HA   ARG  35           HA       ARG  35   7.764   2.421  14.718
  262   1HB   ARG  35          HB2       ARG  35   9.581   0.010  14.898
  263   2HB   ARG  35          HB1       ARG  35   8.089   0.084  13.967
  264   1HG   ARG  35          HG2       ARG  35   9.019   1.838  12.570
  265   2HG   ARG  35          HG1       ARG  35  10.499   1.837  13.528
  266   1HD   ARG  35          HD2       ARG  35  10.871  -0.514  12.877
  267   2HD   ARG  35          HD1       ARG  35   9.440  -0.430  11.852
  268    HE   ARG  35           HE       ARG  35  11.144   1.665  11.131
  269   1HH1  ARG  35          HH11      ARG  35  11.052  -1.836  11.028
  270   2HH1  ARG  35          HH12      ARG  35  12.106  -1.958   9.651
  271   1HH2  ARG  35          HH21      ARG  35  12.522   1.512   9.314
  272   2HH2  ARG  35          HH22      ARG  35  12.925  -0.054   8.663
  273    H    ILE  36           HN       ILE  36   5.888   1.742  15.502
  274    HA   ILE  36           HA       ILE  36   5.893   0.647  18.225
  275    HB   ILE  36           HB       ILE  36   4.597   2.695  17.910
  276   1HG1  ILE  36          HG12      ILE  36   2.799   0.295  18.321
  277   2HG1  ILE  36          HG11      ILE  36   3.859   0.982  19.547
  278   1HG2  ILE  36          HG21      ILE  36   4.027   2.482  15.561
  279   2HG2  ILE  36          HG22      ILE  36   2.569   2.716  16.525
  280   3HG2  ILE  36          HG23      ILE  36   2.977   1.111  15.919
  281   1HD1  ILE  36          HD11      ILE  36   1.542   1.682  19.835
  282   2HD1  ILE  36          HD12      ILE  36   1.564   2.407  18.227
  283   3HD1  ILE  36          HD13      ILE  36   2.601   3.052  19.500
  284    H    CYS  37           HN       CYS  37   5.224  -1.282  18.675
  285    HA   CYS  37           HA       CYS  37   4.812  -3.167  16.566
  286   1HB   CYS  37          HB2       CYS  37   6.092  -3.699  18.561
  287   2HB   CYS  37          HB1       CYS  37   4.689  -3.394  19.570
  288    H    ARG  38           HN       ARG  38   2.924  -3.453  15.581
  289    HA   ARG  38           HA       ARG  38   0.513  -2.268  16.501
  290   1HB   ARG  38          HB2       ARG  38   1.131  -4.133  14.217
  291   2HB   ARG  38          HB1       ARG  38  -0.481  -3.503  14.515
  292   1HG   ARG  38          HG2       ARG  38   1.950  -1.804  14.012
  293   2HG   ARG  38          HG1       ARG  38   0.768  -2.264  12.786
  294   1HD   ARG  38          HD2       ARG  38   0.280  -0.602  15.253
  295   2HD   ARG  38          HD1       ARG  38   0.262  -0.051  13.578
  296    HE   ARG  38           HE       ARG  38  -1.686  -2.038  14.543
  297   1HH1  ARG  38          HH11      ARG  38  -0.936   1.041  13.043
  298   2HH1  ARG  38          HH12      ARG  38  -2.587   1.353  12.594
  299   1HH2  ARG  38          HH21      ARG  38  -3.854  -1.608  13.943
  300   2HH2  ARG  38          HH22      ARG  38  -4.237  -0.132  13.117
  301    H    THR  39           HN       THR  39   1.854  -4.920  17.755
  302    HA   THR  39           HA       THR  39  -0.668  -6.399  17.925
  303    HB   THR  39           HB       THR  39   1.968  -7.453  18.909
  304    HG1  THR  39           HG1      THR  39   1.000  -7.779  16.249
  305   1HG2  THR  39          HG21      THR  39  -0.491  -8.772  17.749
  306   2HG2  THR  39          HG22      THR  39  -0.064  -8.702  19.459
  307   3HG2  THR  39          HG23      THR  39   0.949  -9.607  18.333
  308    H    CYS  40           HN       CYS  40   1.797  -4.822  19.911
  309    HA   CYS  40           HA       CYS  40   0.058  -5.263  22.229
  310   1HB   CYS  40          HB2       CYS  40   1.897  -5.928  23.635
  311   2HB   CYS  40          HB1       CYS  40   1.889  -6.955  22.208
  312    H    GLY  41           HN       GLY  41   1.438  -3.013  20.338
  313   1HA   GLY  41          HA2       GLY  41   1.451  -0.727  20.597
  314   2HA   GLY  41          HA1       GLY  41   0.873  -0.958  22.237
  315    H    HIS  42           HN       HIS  42   3.748  -2.663  21.571
  316    HA   HIS  42           HA       HIS  42   5.175  -0.920  23.395
  317   1HB   HIS  42          HB2       HIS  42   5.233  -3.467  23.476
  318   2HB   HIS  42          HB1       HIS  42   6.229  -3.401  22.027
  319    HD1  HIS  42           HD1      HIS  42   6.365  -3.102  25.692
  320    HD2  HIS  42           HD2      HIS  42   8.822  -2.205  22.457
  321    HE1  HIS  42           HE1      HIS  42   8.673  -2.821  26.648
  322    HE2  HIS  42           HE2      HIS  42  10.098  -2.089  24.704
  323    H    VAL  43           HN       VAL  43   6.692   0.532  22.832
  324    HA   VAL  43           HA       VAL  43   7.129   0.916  19.960
  325    HB   VAL  43           HB       VAL  43   7.867   2.780  22.222
  326   1HG1  VAL  43          HG11      VAL  43   9.128   3.172  20.178
  327   2HG1  VAL  43          HG12      VAL  43   7.975   4.478  20.452
  328   3HG1  VAL  43          HG13      VAL  43   7.631   3.237  19.248
  329   1HG2  VAL  43          HG21      VAL  43   5.473   2.465  22.232
  330   2HG2  VAL  43          HG22      VAL  43   5.396   2.734  20.491
  331   3HG2  VAL  43          HG23      VAL  43   5.848   4.056  21.569
  332    H    GLY  44           HN       GLY  44   9.002   0.469  18.997
  333   1HA   GLY  44          HA2       GLY  44  11.401   0.196  20.692
  334   2HA   GLY  44          HA1       GLY  44  10.984  -1.045  19.518
  335    H    CYS  45           HN       CYS  45  13.414   0.452  19.580
  336    HA   CYS  45           HA       CYS  45  13.278   2.444  17.515
  337   1HB   CYS  45          HB2       CYS  45  15.704   2.529  17.715
  338   2HB   CYS  45          HB1       CYS  45  14.976   2.537  19.318
  339    HG   CYS  45           HG       CYS  45  16.481  -0.125  17.792
  340    H    CYS  46           HN       CYS  46  14.111   2.275  15.434
  341    HA   CYS  46           HA       CYS  46  13.584  -0.089  14.034
  342   1HB   CYS  46          HB2       CYS  46  13.509   2.049  12.927
  343   2HB   CYS  46          HB1       CYS  46  15.199   2.358  13.298
  344    HG   CYS  46           HG       CYS  46  14.376  -0.290  11.311
  345    H    ASP  47           HN       ASP  47  15.014  -1.473  12.870
  346    HA   ASP  47           HA       ASP  47  17.196  -2.498  14.329
  347   1HB   ASP  47          HB2       ASP  47  17.571  -3.921  12.372
  348   2HB   ASP  47          HB1       ASP  47  15.855  -3.844  12.765
  349    H    ASP  48           HN       ASP  48  16.952   0.074  12.057
  350    HA   ASP  48           HA       ASP  48  19.579   0.228  11.110
  351   1HB   ASP  48          HB2       ASP  48  17.691   1.637  10.298
  352   2HB   ASP  48          HB1       ASP  48  17.758   2.544  11.806
  353    H    SER  49           HN       SER  49  18.117   1.345  14.105
  354    HA   SER  49           HA       SER  49  20.495   2.610  15.084
  355   1HB   SER  49          HB2       SER  49  18.033   1.714  16.607
  356   2HB   SER  49          HB1       SER  49  19.233   2.891  17.146
  357    HG   SER  49           HG       SER  49  18.375   3.656  14.760
  358    HA   PRO  50           HA       PRO  50  22.966  -0.759  16.274
  359   1HB   PRO  50          HB2       PRO  50  23.676   0.091  18.856
  360   2HB   PRO  50          HB1       PRO  50  24.527   0.458  17.354
  361   1HG   PRO  50          HG2       PRO  50  22.546   2.095  18.863
  362   2HG   PRO  50          HG1       PRO  50  23.974   2.614  17.948
  363   1HD   PRO  50          HD2       PRO  50  21.522   2.939  16.954
  364   2HD   PRO  50          HD1       PRO  50  22.871   2.454  15.903
  365    H    HIS  51           HN       HIS  51  20.513   0.215  18.605
  366    HA   HIS  51           HA       HIS  51  20.673  -2.063  20.266
  367   1HB   HIS  51          HB2       HIS  51  18.594   0.036  19.789
  368   2HB   HIS  51          HB1       HIS  51  18.176  -1.390  20.729
  369    HD1  HIS  51           HD1      HIS  51  18.075  -0.543  23.058
  370    HD2  HIS  51           HD2      HIS  51  21.495   0.745  21.066
  371    HE1  HIS  51           HE1      HIS  51  19.439   0.688  24.776
  372    HE2  HIS  51           HE2      HIS  51  21.612   1.222  23.606
  373    H    LYS  52           HN       LYS  52  18.787  -1.365  17.360
  374    HA   LYS  52           HA       LYS  52  17.312  -2.586  16.118
  375   1HB   LYS  52          HB2       LYS  52  19.069  -4.895  16.959
  376   2HB   LYS  52          HB1       LYS  52  17.991  -4.860  15.576
  377   1HG   LYS  52          HG2       LYS  52  19.371  -2.996  14.650
  378   2HG   LYS  52          HG1       LYS  52  20.515  -3.280  15.967
  379   1HD   LYS  52          HD2       LYS  52  20.701  -5.641  15.217
  380   2HD   LYS  52          HD1       LYS  52  19.668  -5.240  13.843
  381   1HE   LYS  52          HE2       LYS  52  22.266  -3.845  14.434
  382   2HE   LYS  52          HE1       LYS  52  22.141  -5.251  13.379
  383   1HZ   LYS  52          HZ1       LYS  52  20.786  -2.637  12.982
  384   2HZ   LYS  52          HZ2       LYS  52  20.602  -3.989  11.979
  385   3HZ   LYS  52          HZ3       LYS  52  22.111  -3.222  12.100
  386    H    HIS  53           HN       HIS  53  16.394  -2.169  18.761
  387    HA   HIS  53           HA       HIS  53  15.774  -4.632  20.026
  388   1HB   HIS  53          HB2       HIS  53  15.958  -2.250  21.067
  389   2HB   HIS  53          HB1       HIS  53  14.252  -2.128  20.635
  390    HD1  HIS  53           HD1      HIS  53  12.965  -2.531  22.739
  391    HD2  HIS  53           HD2      HIS  53  16.174  -5.136  22.344
  392    HE1  HIS  53           HE1      HIS  53  12.795  -4.113  24.681
  393    HE2  HIS  53           HE2      HIS  53  14.871  -5.533  24.538
  394    H    ALA  54           HN       ALA  54  14.280  -2.923  17.473
  395    HA   ALA  54           HA       ALA  54  11.614  -3.813  17.829
  396   1HB   ALA  54          HB1       ALA  54  11.292  -3.217  15.490
  397   2HB   ALA  54          HB2       ALA  54  13.037  -3.103  15.264
  398   3HB   ALA  54          HB3       ALA  54  12.209  -1.965  16.328
  399    H    THR  55           HN       THR  55  14.337  -5.110  15.931
  400    HA   THR  55           HA       THR  55  12.906  -7.356  14.947
  401    HB   THR  55           HB       THR  55  15.276  -8.242  14.495
  402    HG1  THR  55           HG1      THR  55  16.819  -7.166  15.457
  403   1HG2  THR  55          HG21      THR  55  13.935  -7.107  12.789
  404   2HG2  THR  55          HG22      THR  55  15.638  -6.669  12.654
  405   3HG2  THR  55          HG23      THR  55  14.495  -5.544  13.386
  406    H    ARG  56           HN       ARG  56  15.069  -6.808  17.662
  407    HA   ARG  56           HA       ARG  56  15.213  -9.418  18.658
  408   1HB   ARG  56          HB2       ARG  56  15.269  -6.776  20.123
  409   2HB   ARG  56          HB1       ARG  56  15.720  -8.320  20.834
  410   1HG   ARG  56          HG2       ARG  56  17.566  -8.543  19.325
  411   2HG   ARG  56          HG1       ARG  56  17.062  -7.107  18.432
  412   1HD   ARG  56          HD2       ARG  56  18.937  -6.680  19.981
  413   2HD   ARG  56          HD1       ARG  56  17.510  -5.707  20.334
  414    HE   ARG  56           HE       ARG  56  17.069  -7.607  22.045
  415   1HH1  ARG  56          HH11      ARG  56  20.212  -6.340  21.148
  416   2HH1  ARG  56          HH12      ARG  56  20.918  -6.647  22.710
  417   1HH2  ARG  56          HH21      ARG  56  17.987  -7.981  24.098
  418   2HH2  ARG  56          HH22      ARG  56  19.642  -7.536  24.399
  419    H    HIS  57           HN       HIS  57  12.890  -6.821  19.284
  420    HA   HIS  57           HA       HIS  57  11.357  -8.114  21.232
  421   1HB   HIS  57          HB2       HIS  57  11.120  -5.733  20.794
  422   2HB   HIS  57          HB1       HIS  57  10.533  -6.058  19.167
  423    HD1  HIS  57           HD1      HIS  57   9.444  -6.107  22.769
  424    HD2  HIS  57           HD2      HIS  57   7.879  -6.821  18.976
  425    HE1  HIS  57           HE1      HIS  57   6.935  -6.293  23.048
  426    H    PHE  58           HN       PHE  58  11.220  -8.245  17.713
  427    HA   PHE  58           HA       PHE  58   8.821  -9.649  17.432
  428   1HB   PHE  58          HB2       PHE  58   9.775  -8.739  15.468
  429   2HB   PHE  58          HB1       PHE  58  11.312  -9.550  15.741
  430    HD1  PHE  58           HD1      PHE  58   7.771 -10.748  15.609
  431    HD2  PHE  58           HD2      PHE  58  11.720 -11.054  14.088
  432    HE1  PHE  58           HE1      PHE  58   7.064 -12.607  14.163
  433    HE2  PHE  58           HE2      PHE  58  11.025 -12.908  12.632
  434    HZ   PHE  58           HZ       PHE  58   8.693 -13.691  12.672
  435    H    HIS  59           HN       HIS  59  12.134 -10.871  17.849
  436    HA   HIS  59           HA       HIS  59  11.323 -13.606  17.714
  437   1HB   HIS  59          HB2       HIS  59  13.869 -12.301  18.684
  438   2HB   HIS  59          HB1       HIS  59  13.634 -14.045  18.654
  439    HD1  HIS  59           HD1      HIS  59  14.311 -15.190  16.552
  440    HD2  HIS  59           HD2      HIS  59  13.606 -11.128  15.971
  441    HE1  HIS  59           HE1      HIS  59  14.958 -14.718  14.166
  442    HE2  HIS  59           HE2      HIS  59  14.386 -12.290  13.793
  443    H    ALA  60           HN       ALA  60  11.625 -11.251  20.254
  444    HA   ALA  60           HA       ALA  60  11.613 -13.110  22.418
  445   1HB   ALA  60          HB1       ALA  60  12.592 -10.870  22.599
  446   2HB   ALA  60          HB2       ALA  60  11.374 -11.165  23.839
  447   3HB   ALA  60          HB3       ALA  60  10.984 -10.164  22.440
  448    H    THR  61           HN       THR  61   9.088 -11.060  20.947
  449    HA   THR  61           HA       THR  61   7.140 -12.290  22.767
  450    HB   THR  61           HB       THR  61   5.582 -10.502  21.907
  451    HG1  THR  61           HG1      THR  61   8.017  -9.571  20.747
  452   1HG2  THR  61          HG21      THR  61   8.111  -9.546  23.250
  453   2HG2  THR  61          HG22      THR  61   6.748 -10.317  24.061
  454   3HG2  THR  61          HG23      THR  61   6.538  -8.743  23.289
  455    H    GLY  62           HN       GLY  62   8.105 -12.319  19.465
  456   1HA   GLY  62          HA2       GLY  62   7.300 -13.611  17.720
  457   2HA   GLY  62          HA1       GLY  62   6.034 -14.203  18.788
  458    H    HIS  63           HN       HIS  63   6.877 -10.909  17.774
  459    HA   HIS  63           HA       HIS  63   4.117 -10.627  16.772
  460   1HB   HIS  63          HB2       HIS  63   5.817  -8.598  18.244
  461   2HB   HIS  63          HB1       HIS  63   4.308  -8.199  17.431
  462    HD2  HIS  63           HD2      HIS  63   3.077 -11.231  18.726
  463    HE1  HIS  63           HE1      HIS  63   3.102  -8.761  22.164
  464    HE2  HIS  63           HE2      HIS  63   2.043 -10.792  21.069
  465    HA   PRO  64           HA       PRO  64   6.852 -10.154  13.256
  466   1HB   PRO  64          HB2       PRO  64   5.155 -10.987  11.367
  467   2HB   PRO  64          HB1       PRO  64   5.843 -12.102  12.555
  468   1HG   PRO  64          HG2       PRO  64   3.136 -10.829  12.496
  469   2HG   PRO  64          HG1       PRO  64   3.580 -12.497  12.901
  470   1HD   PRO  64          HD2       PRO  64   3.076 -10.529  14.760
  471   2HD   PRO  64          HD1       PRO  64   4.077 -11.961  15.066
  472    H    ILE  65           HN       ILE  65   4.184  -8.164  13.937
  473    HA   ILE  65           HA       ILE  65   4.790  -6.580  11.536
  474    HB   ILE  65           HB       ILE  65   2.045  -6.973  12.729
  475   1HG1  ILE  65          HG12      ILE  65   3.257  -7.741  10.064
  476   2HG1  ILE  65          HG11      ILE  65   2.732  -8.841  11.334
  477   1HG2  ILE  65          HG21      ILE  65   2.899  -5.212  10.430
  478   2HG2  ILE  65          HG22      ILE  65   2.380  -4.651  12.019
  479   3HG2  ILE  65          HG23      ILE  65   1.241  -5.487  10.963
  480   1HD1  ILE  65          HD11      ILE  65   1.143  -8.769   9.500
  481   2HD1  ILE  65          HD12      ILE  65   0.951  -7.029   9.719
  482   3HD1  ILE  65          HD13      ILE  65   0.423  -8.142  10.982
  483    H    ILE  66           HN       ILE  66   5.348  -4.594  11.846
  484    HA   ILE  66           HA       ILE  66   4.556  -3.207  14.320
  485    HB   ILE  66           HB       ILE  66   6.732  -1.960  14.171
  486   1HG1  ILE  66          HG12      ILE  66   7.467  -4.209  12.283
  487   2HG1  ILE  66          HG11      ILE  66   7.217  -2.533  11.811
  488   1HG2  ILE  66          HG21      ILE  66   6.378  -3.726  15.814
  489   2HG2  ILE  66          HG22      ILE  66   8.049  -3.711  15.251
  490   3HG2  ILE  66          HG23      ILE  66   6.927  -4.931  14.649
  491   1HD1  ILE  66          HD11      ILE  66   9.574  -3.061  11.980
  492   2HD1  ILE  66          HD12      ILE  66   9.359  -3.546  13.662
  493   3HD1  ILE  66          HD13      ILE  66   9.111  -1.864  13.190
  494    H    GLU  67           HN       GLU  67   4.981  -0.743  13.970
  495    HA   GLU  67           HA       GLU  67   4.239   0.013  11.232
  496   1HB   GLU  67          HB2       GLU  67   2.182  -0.129  12.511
  497   2HB   GLU  67          HB1       GLU  67   2.868   0.858  13.789
  498   1HG   GLU  67          HG2       GLU  67   2.841   2.794  12.425
  499   2HG   GLU  67          HG1       GLU  67   2.459   1.849  10.985
  500    H    GLY  68           HN       GLY  68   5.008   1.985  10.549
  501   1HA   GLY  68          HA2       GLY  68   7.300   3.041  11.840
  502   2HA   GLY  68          HA1       GLY  68   6.451   3.776  10.485
  503    H    TYR  69           HN       TYR  69   7.184   4.023  13.754
  504    HA   TYR  69           HA       TYR  69   4.787   5.539  14.421
  505   1HB   TYR  69          HB2       TYR  69   5.620   3.809  15.985
  506   2HB   TYR  69          HB1       TYR  69   7.113   4.723  16.175
  507    HD1  TYR  69           HD1      TYR  69   7.287   6.179  17.958
  508    HD2  TYR  69           HD2      TYR  69   3.419   5.172  16.506
  509    HE1  TYR  69           HE1      TYR  69   6.270   7.467  19.786
  510    HE2  TYR  69           HE2      TYR  69   2.393   6.460  18.330
  511    HH   TYR  69           HH       TYR  69   3.127   7.184  20.699
  512    H    ASP  70           HN       ASP  70   8.279   5.971  14.091
  513    HA   ASP  70           HA       ASP  70   8.235   8.659  15.035
  514   1HB   ASP  70          HB2       ASP  70  10.541   8.775  14.569
  515   2HB   ASP  70          HB1       ASP  70  10.251   7.113  15.050
  516    HA   PRO  71           HA       PRO  71   8.082   9.996  10.522
  517   1HB   PRO  71          HB2       PRO  71   7.457   8.304   8.542
  518   2HB   PRO  71          HB1       PRO  71   9.104   8.427   9.169
  519   1HG   PRO  71          HG2       PRO  71   7.060   6.321   9.610
  520   2HG   PRO  71          HG1       PRO  71   8.824   6.183   9.545
  521   1HD   PRO  71          HD2       PRO  71   7.224   6.299  11.862
  522   2HD   PRO  71          HD1       PRO  71   8.990   6.431  11.786
  523    HA   PRO  72           HA       PRO  72   3.633  10.464  10.910
  524   1HB   PRO  72          HB2       PRO  72   3.457  12.767   9.488
  525   2HB   PRO  72          HB1       PRO  72   4.060  12.712  11.148
  526   1HG   PRO  72          HG2       PRO  72   5.590  12.828   8.578
  527   2HG   PRO  72          HG1       PRO  72   5.871  13.714  10.088
  528   1HD   PRO  72          HD2       PRO  72   7.297  11.515   9.392
  529   2HD   PRO  72          HD1       PRO  72   6.944  11.933  11.081
  530    H    GLU  73           HN       GLU  73   4.547   8.606   8.977
  531    HA   GLU  73           HA       GLU  73   3.123   9.335   6.515
  532   1HB   GLU  73          HB2       GLU  73   4.912   6.961   7.073
  533   2HB   GLU  73          HB1       GLU  73   4.234   7.403   5.513
  534   1HG   GLU  73          HG2       GLU  73   5.550   9.443   5.497
  535   2HG   GLU  73          HG1       GLU  73   6.198   9.050   7.090
  536    H    GLY  74           HN       GLY  74   3.498   6.494   8.638
  537   1HA   GLY  74          HA2       GLY  74   1.698   5.273   9.579
  538   2HA   GLY  74          HA1       GLY  74   0.626   5.986   8.382
  539    H    TRP  75           HN       TRP  75   3.279   3.686   8.787
  540    HA   TRP  75           HA       TRP  75   2.009   1.982   6.803
  541   1HB   TRP  75          HB2       TRP  75   4.296   1.476   5.801
  542   2HB   TRP  75          HB1       TRP  75   3.574   3.019   5.372
  543    HD1  TRP  75           HD1      TRP  75   4.920   5.159   5.903
  544    HE1  TRP  75           HE1      TRP  75   7.228   5.639   6.937
  545    HE3  TRP  75           HE3      TRP  75   5.967   0.492   7.718
  546    HZ2  TRP  75           HZ2      TRP  75   9.223   4.215   8.347
  547    HZ3  TRP  75           HZ3      TRP  75   8.097   0.136   8.896
  548    HH2  TRP  75           HH2      TRP  75   9.691   1.960   9.203
  549    H    GLY  76           HN       GLY  76   2.699  -0.227   6.900
  550   1HA   GLY  76          HA2       GLY  76   3.762  -0.904   9.570
  551   2HA   GLY  76          HA1       GLY  76   2.527  -1.840   8.740
  552    H    TRP  77           HN       TRP  77   5.173  -2.581   9.791
  553    HA   TRP  77           HA       TRP  77   6.357  -3.619   7.298
  554   1HB   TRP  77          HB2       TRP  77   7.873  -2.026   8.369
  555   2HB   TRP  77          HB1       TRP  77   7.741  -2.893   9.894
  556    HD1  TRP  77           HD1      TRP  77   9.284  -4.991  10.239
  557    HE1  TRP  77           HE1      TRP  77  11.207  -6.030   8.870
  558    HE3  TRP  77           HE3      TRP  77   8.638  -2.424   5.866
  559    HZ2  TRP  77           HZ2      TRP  77  12.297  -5.784   6.280
  560    HZ3  TRP  77           HZ3      TRP  77  10.164  -2.882   3.993
  561    HH2  TRP  77           HH2      TRP  77  11.956  -4.528   4.197
  562    H    CYS  78           HN       CYS  78   6.434  -5.769   7.126
  563    HA   CYS  78           HA       CYS  78   5.837  -7.358   9.536
  564   1HB   CYS  78          HB2       CYS  78   4.323  -7.409   7.410
  565   2HB   CYS  78          HB1       CYS  78   5.600  -8.402   6.727
  566    H    TYR  79           HN       TYR  79   7.539  -8.373  10.374
  567    HA   TYR  79           HA       TYR  79  10.107  -8.111   9.365
  568   1HB   TYR  79          HB2       TYR  79   9.019 -10.050  11.397
  569   2HB   TYR  79          HB1       TYR  79  10.736  -9.860  11.062
  570    HD1  TYR  79           HD1      TYR  79  11.784  -7.583  11.438
  571    HD2  TYR  79           HD2      TYR  79   7.917  -8.608  12.877
  572    HE1  TYR  79           HE1      TYR  79  11.908  -5.744  13.064
  573    HE2  TYR  79           HE2      TYR  79   8.026  -6.770  14.502
  574    HH   TYR  79           HH       TYR  79   9.900  -5.481  15.677
  575    H    VAL  80           HN       VAL  80   8.364 -11.231   9.595
  576    HA   VAL  80           HA       VAL  80  10.368 -12.630   8.190
  577    HB   VAL  80           HB       VAL  80   8.644 -14.465   7.998
  578   1HG1  VAL  80          HG11      VAL  80   9.086 -13.286  10.740
  579   2HG1  VAL  80          HG12      VAL  80  10.229 -14.303   9.861
  580   3HG1  VAL  80          HG13      VAL  80   8.678 -14.964  10.380
  581   1HG2  VAL  80          HG21      VAL  80   6.578 -14.211   9.283
  582   2HG2  VAL  80          HG22      VAL  80   6.642 -13.065   7.944
  583   3HG2  VAL  80          HG23      VAL  80   6.972 -12.520   9.589
  584    H    ASP  81           HN       ASP  81   7.721 -10.761   7.079
  585    HA   ASP  81           HA       ASP  81   7.634 -11.976   4.445
  586   1HB   ASP  81          HB2       ASP  81   6.315  -9.437   5.436
  587   2HB   ASP  81          HB1       ASP  81   5.963 -10.267   3.928
  588    H    GLU  82           HN       GLU  82   8.891  -9.143   6.045
  589    HA   GLU  82           HA       GLU  82  10.370  -7.536   5.481
  590   1HB   GLU  82          HB2       GLU  82  10.987  -9.307   3.111
  591   2HB   GLU  82          HB1       GLU  82  11.937  -7.915   3.615
  592   1HG   GLU  82          HG2       GLU  82  12.351  -9.040   5.779
  593   2HG   GLU  82          HG1       GLU  82  11.501 -10.457   5.164
  594    H    VAL  83           HN       VAL  83   7.582  -7.689   4.432
  595    HA   VAL  83           HA       VAL  83   7.864  -5.838   2.171
  596    HB   VAL  83           HB       VAL  83   5.525  -6.304   1.614
  597   1HG1  VAL  83          HG11      VAL  83   7.202  -8.792   1.894
  598   2HG1  VAL  83          HG12      VAL  83   7.259  -7.635   0.564
  599   3HG1  VAL  83          HG13      VAL  83   5.811  -8.607   0.826
  600   1HG2  VAL  83          HG21      VAL  83   5.623  -8.283   3.890
  601   2HG2  VAL  83          HG22      VAL  83   4.318  -8.149   2.711
  602   3HG2  VAL  83          HG23      VAL  83   4.647  -6.816   3.818
  603    H    MET  84           HN       MET  84   7.050  -3.833   2.275
  604    HA   MET  84           HA       MET  84   5.879  -2.978   4.833
  605   1HB   MET  84          HB2       MET  84   7.993  -1.878   4.143
  606   2HB   MET  84          HB1       MET  84   7.203  -1.320   2.675
  607   1HG   MET  84          HG2       MET  84   5.625  -0.026   4.037
  608   2HG   MET  84          HG1       MET  84   6.466  -0.557   5.492
  609   1HE   MET  84          HE1       MET  84   9.002   0.157   6.081
  610   2HE   MET  84          HE2       MET  84  10.010   1.089   4.972
  611   3HE   MET  84          HE3       MET  84   9.483  -0.536   4.532
  612    H    PHE  85           HN       PHE  85   3.877  -2.157   4.898
  613    HA   PHE  85           HA       PHE  85   2.529  -1.521   2.368
  614   1HB   PHE  85          HB2       PHE  85   0.447  -2.596   3.357
  615   2HB   PHE  85          HB1       PHE  85   1.714  -3.702   2.840
  616    HD1  PHE  85           HD1      PHE  85  -0.041  -2.273   5.720
  617    HD2  PHE  85           HD2      PHE  85   2.943  -5.020   4.431
  618    HE1  PHE  85           HE1      PHE  85  -0.040  -3.313   7.949
  619    HE2  PHE  85           HE2      PHE  85   2.948  -6.067   6.658
  620    HZ   PHE  85           HZ       PHE  85   1.457  -5.212   8.420
  621    H    ASP  86           HN       ASP  86   0.723  -0.053   2.596
  622    HA   ASP  86           HA       ASP  86   1.300   1.953   4.575
  623   1HB   ASP  86          HB2       ASP  86   0.675   2.522   2.231
  624   2HB   ASP  86          HB1       ASP  86  -0.937   1.885   2.536
  625    H    LEU  87           HN       LEU  87   0.187   2.462   6.365
  626    HA   LEU  87           HA       LEU  87  -2.327   1.029   6.912
  627   1HB   LEU  87          HB2       LEU  87   0.100   1.318   8.642
  628   2HB   LEU  87          HB1       LEU  87  -1.483   1.199   9.382
  629    HG   LEU  87           HG       LEU  87  -0.204  -0.875   7.599
  630   1HD1  LEU  87          HD11      LEU  87  -0.812  -0.873  10.552
  631   2HD1  LEU  87          HD12      LEU  87   0.791  -0.716   9.831
  632   3HD1  LEU  87          HD13      LEU  87  -0.123  -2.212   9.633
  633   1HD2  LEU  87          HD21      LEU  87  -2.625  -0.823   7.313
  634   2HD2  LEU  87          HD22      LEU  87  -2.844  -0.891   9.064
  635   3HD2  LEU  87          HD23      LEU  87  -2.132  -2.261   8.207
  636    H    SER  88           HN       SER  88  -1.502   3.844   6.025
  637    HA   SER  88           HA       SER  88  -1.659   5.599   8.215
  638   1HB   SER  88          HB2       SER  88  -0.809   6.051   5.832
  639   2HB   SER  88          HB1       SER  88  -2.497   6.340   5.417
  640    HG   SER  88           HG       SER  88  -0.757   7.833   7.010
  641    H    ASP  89           HN       ASP  89  -4.144   4.011   6.381
  642    HA   ASP  89           HA       ASP  89  -6.313   5.717   7.128
  643   1HB   ASP  89          HB2       ASP  89  -6.498   4.294   5.179
  644   2HB   ASP  89          HB1       ASP  89  -6.210   2.855   6.147
  645    H    ARG  90           HN       ARG  90  -4.538   3.289   8.738
  646    HA   ARG  90           HA       ARG  90  -6.492   3.143  10.915
  647   1HB   ARG  90          HB2       ARG  90  -5.850   0.607  10.968
  648   2HB   ARG  90          HB1       ARG  90  -7.087   1.165   9.850
  649   1HG   ARG  90          HG2       ARG  90  -5.309   1.313   8.103
  650   2HG   ARG  90          HG1       ARG  90  -4.218   0.522   9.240
  651   1HD   ARG  90          HD2       ARG  90  -5.215  -1.068   7.659
  652   2HD   ARG  90          HD1       ARG  90  -5.667  -1.419   9.326
  653    HE   ARG  90           HE       ARG  90  -7.862  -0.728   8.868
  654   1HH1  ARG  90          HH11      ARG  90  -5.796  -0.403   6.043
  655   2HH1  ARG  90          HH12      ARG  90  -7.129  -0.341   4.928
  656   1HH2  ARG  90          HH21      ARG  90  -9.598  -0.671   7.394
  657   2HH2  ARG  90          HH22      ARG  90  -9.288  -0.496   5.691
  658    H    MET  91           HN       MET  91  -4.031   4.566  10.714
  659    HA   MET  91           HA       MET  91  -1.946   2.928  11.860
  660   1HB   MET  91          HB2       MET  91  -0.518   4.861  11.623
  661   2HB   MET  91          HB1       MET  91  -1.425   4.618  10.139
  662   1HG   MET  91          HG2       MET  91  -2.900   6.425  10.668
  663   2HG   MET  91          HG1       MET  91  -2.188   6.596  12.272
  664   1HE   MET  91          HE1       MET  91   0.904   6.179  11.615
  665   2HE   MET  91          HE2       MET  91   0.305   7.433  12.701
  666   3HE   MET  91          HE3       MET  91   1.427   7.851  11.405
  667    H    THR  92           HN       THR  92  -0.675   3.737  13.695
  668    HA   THR  92           HA       THR  92  -2.423   4.519  15.888
  669    HB   THR  92           HB       THR  92   0.524   3.921  16.095
  670    HG1  THR  92           HG1      THR  92  -0.355   2.151  15.024
  671   1HG2  THR  92          HG21      THR  92  -0.114   3.157  18.340
  672   2HG2  THR  92          HG22      THR  92  -1.794   3.566  17.999
  673   3HG2  THR  92          HG23      THR  92  -0.575   4.838  18.076
  674    HA   PRO  93           HA       PRO  93  -1.041   8.771  15.405
  675   1HB   PRO  93          HB2       PRO  93  -2.478   9.186  17.935
  676   2HB   PRO  93          HB1       PRO  93  -2.765   9.911  16.351
  677   1HG   PRO  93          HG2       PRO  93  -4.444   8.097  17.409
  678   2HG   PRO  93          HG1       PRO  93  -4.139   8.192  15.665
  679   1HD   PRO  93          HD2       PRO  93  -3.024   6.281  17.684
  680   2HD   PRO  93          HD1       PRO  93  -3.595   5.966  16.030
  681    H    HIS  94           HN       HIS  94   0.181  10.314  16.700
  682    HA   HIS  94           HA       HIS  94   2.194   8.949  18.240
  683   1HB   HIS  94          HB2       HIS  94   1.837  11.875  17.555
  684   2HB   HIS  94          HB1       HIS  94   3.223  11.226  18.423
  685    HD1  HIS  94           HD1      HIS  94   3.860  12.639  15.880
  686    HD2  HIS  94           HD2      HIS  94   2.908   8.592  15.986
  687    HE1  HIS  94           HE1      HIS  94   4.844  11.655  13.786
  688    HE2  HIS  94           HE2      HIS  94   4.472   9.174  14.015
  689    H    ASN  95           HN       ASN  95   2.754   9.363  20.398
  690    HA   ASN  95           HA       ASN  95   0.418   9.943  22.052
  691   1HB   ASN  95          HB2       ASN  95   1.848   7.853  22.300
  692   2HB   ASN  95          HB1       ASN  95   3.106   8.896  22.950
  693   1HD2  ASN  95          HD21      ASN  95   3.065   7.830  24.916
  694   2HD2  ASN  95          HD22      ASN  95   1.786   8.050  26.061
  695    H    GLY  96           HN       GLY  96   2.547  11.846  20.711
  696   1HA   GLY  96          HA2       GLY  96   2.288  14.147  21.898
  697   2HA   GLY  96          HA1       GLY  96   3.306  13.364  23.099
  698    HA   PRO  97           HA       PRO  97   5.991  15.455  19.843
  699   1HB   PRO  97          HB2       PRO  97   7.246  16.646  22.227
  700   2HB   PRO  97          HB1       PRO  97   6.686  17.427  20.746
  701   1HG   PRO  97          HG2       PRO  97   5.387  17.732  23.073
  702   2HG   PRO  97          HG1       PRO  97   4.525  17.658  21.524
  703   1HD   PRO  97          HD2       PRO  97   4.877  15.528  23.603
  704   2HD   PRO  97          HD1       PRO  97   3.435  15.950  22.654
  705    H    ILE  98           HN       ILE  98   7.466  14.038  19.199
  706    HA   ILE  98           HA       ILE  98   8.846  12.380  21.177
  707    HB   ILE  98           HB       ILE  98   8.765  12.133  18.165
  708   1HG1  ILE  98          HG12      ILE  98   7.236  10.627  20.299
  709   2HG1  ILE  98          HG11      ILE  98   6.554  11.811  19.188
  710   1HG2  ILE  98          HG21      ILE  98   9.629   9.861  18.557
  711   2HG2  ILE  98          HG22      ILE  98   9.778  10.231  20.275
  712   3HG2  ILE  98          HG23      ILE  98  10.753  11.109  19.096
  713   1HD1  ILE  98          HD11      ILE  98   7.738   9.143  18.467
  714   2HD1  ILE  98          HD12      ILE  98   7.151  10.338  17.309
  715   3HD1  ILE  98          HD13      ILE  98   6.031   9.587  18.446
  716    HA   PRO  99           HA       PRO  99  12.573  14.798  20.669
  717   1HB   PRO  99          HB2       PRO  99  14.250  13.039  21.922
  718   2HB   PRO  99          HB1       PRO  99  13.199  14.173  22.777
  719   1HG   PRO  99          HG2       PRO  99  12.803  11.262  22.230
  720   2HG   PRO  99          HG1       PRO  99  12.436  12.189  23.696
  721   1HD   PRO  99          HD2       PRO  99  10.533  11.475  21.904
  722   2HD   PRO  99          HD1       PRO  99  10.440  12.972  22.853
  723    H    ARG 100           HN       ARG 100  13.151  14.810  18.576
  724    HA   ARG 100           HA       ARG 100  14.166  12.398  17.307
  725   1HB   ARG 100          HB2       ARG 100  12.787  13.577  15.841
  726   2HB   ARG 100          HB1       ARG 100  13.404  15.136  16.356
  727   1HG   ARG 100          HG2       ARG 100  15.241  13.270  14.934
  728   2HG   ARG 100          HG1       ARG 100  14.014  14.147  14.011
  729   1HD   ARG 100          HD2       ARG 100  14.840  16.254  14.851
  730   2HD   ARG 100          HD1       ARG 100  15.991  15.417  15.890
  731    HE   ARG 100           HE       ARG 100  16.842  14.547  13.568
  732   1HH1  ARG 100          HH11      ARG 100  15.580  17.738  14.249
  733   2HH1  ARG 100          HH12      ARG 100  16.691  18.556  13.191
  734   1HH2  ARG 100          HH21      ARG 100  18.328  15.602  12.195
  735   2HH2  ARG 100          HH22      ARG 100  18.263  17.334  12.016
  736    H    TYR 101           HN       TYR 101  16.262  11.993  16.873
  737    HA   TYR 101           HA       TYR 101  18.202  13.921  17.948
  738   1HB   TYR 101          HB2       TYR 101  18.458  10.933  17.549
  739   2HB   TYR 101          HB1       TYR 101  19.741  11.980  18.144
  740    HD1  TYR 101           HD1      TYR 101  19.504  13.074  20.369
  741    HD2  TYR 101           HD2      TYR 101  16.714  10.176  18.985
  742    HE1  TYR 101           HE1      TYR 101  18.695  12.762  22.670
  743    HE2  TYR 101           HE2      TYR 101  15.899   9.859  21.282
  744    HH   TYR 101           HH       TYR 101  16.754  10.166  23.594
  745    H    VAL 102           HN       VAL 102  18.144  11.364  15.465
  746    HA   VAL 102           HA       VAL 102  20.301  12.430  14.008
  747    HB   VAL 102           HB       VAL 102  19.577  10.878  12.183
  748   1HG1  VAL 102          HG11      VAL 102  21.103  10.156  13.935
  749   2HG1  VAL 102          HG12      VAL 102  20.040   8.835  13.449
  750   3HG1  VAL 102          HG13      VAL 102  19.738   9.702  14.955
  751   1HG2  VAL 102          HG21      VAL 102  17.766   9.283  12.670
  752   2HG2  VAL 102          HG22      VAL 102  17.171  10.937  12.526
  753   3HG2  VAL 102          HG23      VAL 102  17.361  10.203  14.119
  Start of MODEL    4
    1   1H    MET   1          HT1       MET   1   4.998   2.271  -0.662
    2   2H    MET   1          HT2       MET   1   4.245   1.732  -2.087
    3   3H    MET   1          HT3       MET   1   5.789   1.165  -1.674
    4    HA   MET   1           HA       MET   1   4.957   0.016   0.215
    5   1HB   MET   1          HB2       MET   1   2.558  -0.038   0.715
    6   2HB   MET   1          HB1       MET   1   3.188   1.598   0.817
    7   1HG   MET   1          HG2       MET   1   1.178   1.898  -0.258
    8   2HG   MET   1          HG1       MET   1   2.319   1.838  -1.601
    9   1HE   MET   1          HE1       MET   1  -0.891   0.120  -3.066
   10   2HE   MET   1          HE2       MET   1   0.272   1.434  -3.248
   11   3HE   MET   1          HE3       MET   1  -0.862   1.441  -1.897
   12    H    THR   2           HN       THR   2   3.773  -2.066   0.096
   13    HA   THR   2           HA       THR   2   3.131  -2.856  -2.661
   14    HB   THR   2           HB       THR   2   5.340  -3.779  -1.998
   15    HG1  THR   2           HG1      THR   2   4.311  -5.070  -3.445
   16   1HG2  THR   2          HG21      THR   2   5.488  -5.502  -0.285
   17   2HG2  THR   2          HG22      THR   2   3.783  -5.280   0.108
   18   3HG2  THR   2          HG23      THR   2   4.935  -3.980   0.414
   19    H    MET   3           HN       MET   3   2.152  -5.352  -2.224
   20    HA   MET   3           HA       MET   3  -0.450  -4.728  -1.279
   21   1HB   MET   3          HB2       MET   3  -0.071  -6.304  -3.116
   22   2HB   MET   3          HB1       MET   3   0.752  -7.404  -2.016
   23   1HG   MET   3          HG2       MET   3  -1.322  -7.673  -0.746
   24   2HG   MET   3          HG1       MET   3  -2.143  -6.585  -1.863
   25   1HE   MET   3          HE1       MET   3  -4.030  -8.408  -2.285
   26   2HE   MET   3          HE2       MET   3  -3.222  -9.490  -1.153
   27   3HE   MET   3          HE3       MET   3  -3.689 -10.074  -2.750
   28    H    GLY   4           HN       GLY   4  -1.393  -5.033   0.622
   29   1HA   GLY   4          HA2       GLY   4   0.058  -5.821   2.924
   30   2HA   GLY   4          HA1       GLY   4  -1.687  -5.611   2.825
   31    H    CYS   5           HN       CYS   5   0.177  -7.731   4.007
   32    HA   CYS   5           HA       CYS   5  -0.674 -10.074   2.480
   33   1HB   CYS   5          HB2       CYS   5   0.940 -11.318   3.830
   34   2HB   CYS   5          HB1       CYS   5   1.703  -9.912   3.098
   35    H    ARG   6           HN       ARG   6  -1.376 -12.009   3.807
   36    HA   ARG   6           HA       ARG   6  -3.777 -11.441   5.074
   37   1HB   ARG   6          HB2       ARG   6  -3.747 -13.818   5.809
   38   2HB   ARG   6          HB1       ARG   6  -3.393 -13.597   4.102
   39   1HG   ARG   6          HG2       ARG   6  -0.981 -13.820   4.623
   40   2HG   ARG   6          HG1       ARG   6  -1.415 -14.172   6.297
   41   1HD   ARG   6          HD2       ARG   6  -2.626 -16.141   5.613
   42   2HD   ARG   6          HD1       ARG   6  -2.363 -15.756   3.913
   43    HE   ARG   6           HE       ARG   6   0.072 -16.051   5.416
   44   1HH1  ARG   6          HH11      ARG   6  -2.406 -17.753   3.610
   45   2HH1  ARG   6          HH12      ARG   6  -1.366 -19.092   3.214
   46   1HH2  ARG   6          HH21      ARG   6   1.426 -17.798   4.911
   47   2HH2  ARG   6          HH22      ARG   6   0.813 -19.128   3.969
   48    H    HIS   7           HN       HIS   7  -0.594 -11.603   6.452
   49    HA   HIS   7           HA       HIS   7  -1.230 -11.931   9.155
   50   1HB   HIS   7          HB2       HIS   7   1.028 -10.392   7.864
   51   2HB   HIS   7          HB1       HIS   7   0.915 -10.695   9.593
   52    HD2  HIS   7           HD2      HIS   7   0.420 -13.757   9.841
   53    HE1  HIS   7           HE1      HIS   7   3.561 -14.230   7.047
   54    HE2  HIS   7           HE2      HIS   7   1.983 -15.437   8.633
   55    H    VAL   8           HN       VAL   8  -1.648  -9.205   7.056
   56    HA   VAL   8           HA       VAL   8  -1.727  -7.150   8.994
   57    HB   VAL   8           HB       VAL   8  -1.647  -7.017   6.364
   58   1HG1  VAL   8          HG11      VAL   8  -3.755  -6.391   5.352
   59   2HG1  VAL   8          HG12      VAL   8  -4.592  -6.695   6.873
   60   3HG1  VAL   8          HG13      VAL   8  -3.843  -8.032   5.995
   61   1HG2  VAL   8          HG21      VAL   8  -2.400  -4.689   6.474
   62   2HG2  VAL   8          HG22      VAL   8  -1.364  -5.118   7.835
   63   3HG2  VAL   8          HG23      VAL   8  -3.111  -5.003   8.056
   64    H    ALA   9           HN       ALA   9  -4.044  -9.545   7.990
   65    HA   ALA   9           HA       ALA   9  -6.312  -8.262   9.199
   66   1HB   ALA   9          HB1       ALA   9  -6.644  -9.792   7.349
   67   2HB   ALA   9          HB2       ALA   9  -7.451 -10.411   8.791
   68   3HB   ALA   9          HB3       ALA   9  -5.915 -11.106   8.272
   69    H    GLY  10           HN       GLY  10  -3.617  -9.539  10.533
   70   1HA   GLY  10          HA2       GLY  10  -5.049 -10.661  12.855
   71   2HA   GLY  10          HA1       GLY  10  -3.392 -11.048  12.419
   72    H    ILE  11           HN       ILE  11  -3.714  -7.816  11.902
   73    HA   ILE  11           HA       ILE  11  -2.496  -7.214  14.499
   74    HB   ILE  11           HB       ILE  11  -1.783  -5.085  13.488
   75   1HG1  ILE  11          HG12      ILE  11  -3.155  -6.185  11.027
   76   2HG1  ILE  11          HG11      ILE  11  -3.587  -4.729  11.913
   77   1HG2  ILE  11          HG21      ILE  11  -0.138  -6.024  11.935
   78   2HG2  ILE  11          HG22      ILE  11  -1.068  -7.520  11.862
   79   3HG2  ILE  11          HG23      ILE  11  -0.319  -7.022  13.378
   80   1HD1  ILE  11          HD11      ILE  11  -2.398  -4.347   9.763
   81   2HD1  ILE  11          HD12      ILE  11  -0.970  -5.095  10.484
   82   3HD1  ILE  11          HD13      ILE  11  -1.627  -3.607  11.170
   83    H    ARG  12           HN       ARG  12  -3.157  -5.361  15.716
   84    HA   ARG  12           HA       ARG  12  -5.899  -4.470  15.128
   85   1HB   ARG  12          HB2       ARG  12  -6.427  -4.608  17.540
   86   2HB   ARG  12          HB1       ARG  12  -6.078  -6.179  16.833
   87   1HG   ARG  12          HG2       ARG  12  -3.817  -6.095  17.775
   88   2HG   ARG  12          HG1       ARG  12  -4.189  -4.530  18.503
   89   1HD   ARG  12          HD2       ARG  12  -4.404  -6.442  20.078
   90   2HD   ARG  12          HD1       ARG  12  -5.891  -5.514  19.883
   91    HE   ARG  12           HE       ARG  12  -6.346  -7.410  18.128
   92   1HH1  ARG  12          HH11      ARG  12  -4.915  -7.748  21.309
   93   2HH1  ARG  12          HH12      ARG  12  -5.525  -9.359  21.544
   94   1HH2  ARG  12          HH21      ARG  12  -7.144  -9.507  18.430
   95   2HH2  ARG  12          HH22      ARG  12  -6.790 -10.367  19.903
   96    H    THR  13           HN       THR  13  -6.517  -2.524  16.390
   97    HA   THR  13           HA       THR  13  -4.523  -0.498  16.301
   98    HB   THR  13           HB       THR  13  -7.217  -0.417  17.682
   99    HG1  THR  13           HG1      THR  13  -8.036  -0.347  15.736
  100   1HG2  THR  13          HG21      THR  13  -5.473   1.805  16.601
  101   2HG2  THR  13          HG22      THR  13  -5.712   1.423  18.306
  102   3HG2  THR  13          HG23      THR  13  -7.065   2.001  17.335
  103    H    VAL  14           HN       VAL  14  -2.965  -0.201  17.743
  104    HA   VAL  14           HA       VAL  14  -3.378  -1.237  20.463
  105    HB   VAL  14           HB       VAL  14  -0.871  -1.402  20.564
  106   1HG1  VAL  14          HG11      VAL  14  -2.237  -3.061  18.447
  107   2HG1  VAL  14          HG12      VAL  14  -2.313  -3.348  20.185
  108   3HG1  VAL  14          HG13      VAL  14  -0.776  -3.500  19.332
  109   1HG2  VAL  14          HG21      VAL  14   0.340  -1.485  18.419
  110   2HG2  VAL  14          HG22      VAL  14  -0.312   0.119  18.751
  111   3HG2  VAL  14          HG23      VAL  14  -1.116  -0.937  17.589
  112    H    THR  15           HN       THR  15  -2.008  -0.157  22.126
  113    HA   THR  15           HA       THR  15  -2.181   2.750  21.733
  114    HB   THR  15           HB       THR  15  -1.990   1.214  24.333
  115    HG1  THR  15           HG1      THR  15  -4.040   1.458  22.643
  116   1HG2  THR  15          HG21      THR  15  -1.243   3.547  24.478
  117   2HG2  THR  15          HG22      THR  15  -2.764   3.310  25.338
  118   3HG2  THR  15          HG23      THR  15  -2.761   4.079  23.751
  119    HA   PRO  16           HA       PRO  16   2.300   2.733  21.751
  120   1HB   PRO  16          HB2       PRO  16   2.072   5.643  21.765
  121   2HB   PRO  16          HB1       PRO  16   2.713   4.584  20.507
  122   1HG   PRO  16          HG2       PRO  16   0.386   5.952  20.239
  123   2HG   PRO  16          HG1       PRO  16   0.685   4.390  19.455
  124   1HD   PRO  16          HD2       PRO  16  -0.889   5.004  21.924
  125   2HD   PRO  16          HD1       PRO  16  -1.239   3.850  20.620
  126    H    SER  17           HN       SER  17   2.834   2.091  23.787
  127    HA   SER  17           HA       SER  17   2.167   3.557  26.132
  128   1HB   SER  17          HB2       SER  17   2.498   1.112  26.121
  129   2HB   SER  17          HB1       SER  17   4.202   1.348  25.740
  130    HG   SER  17           HG       SER  17   3.511   2.797  27.907
  131    H    ALA  18           HN       ALA  18   4.606   3.931  23.810
  132    HA   ALA  18           HA       ALA  18   5.995   5.836  25.541
  133   1HB   ALA  18          HB1       ALA  18   7.416   3.812  23.811
  134   2HB   ALA  18          HB2       ALA  18   7.316   3.764  25.571
  135   3HB   ALA  18          HB3       ALA  18   8.177   5.080  24.772
  136    H    LEU  19           HN       LEU  19   7.372   7.326  24.275
  137    HA   LEU  19           HA       LEU  19   6.135   7.933  21.685
  138   1HB   LEU  19          HB2       LEU  19   7.955   9.681  23.346
  139   2HB   LEU  19          HB1       LEU  19   7.004  10.170  21.956
  140    HG   LEU  19           HG       LEU  19   5.933   9.352  24.656
  141   1HD1  LEU  19          HD11      LEU  19   5.168  11.674  24.765
  142   2HD1  LEU  19          HD12      LEU  19   5.965  12.004  23.227
  143   3HD1  LEU  19          HD13      LEU  19   6.924  11.567  24.641
  144   1HD2  LEU  19          HD21      LEU  19   3.736   9.937  23.762
  145   2HD2  LEU  19          HD22      LEU  19   4.454   8.594  22.872
  146   3HD2  LEU  19          HD23      LEU  19   4.453  10.214  22.174
  147    H    GLY  20           HN       GLY  20   9.343   8.148  23.199
  148   1HA   GLY  20          HA2       GLY  20  10.591   7.514  20.640
  149   2HA   GLY  20          HA1       GLY  20  11.423   8.051  22.093
  150    H    CYS  21           HN       CYS  21  12.858   6.193  21.453
  151    HA   CYS  21           HA       CYS  21  11.881   3.544  21.876
  152   1HB   CYS  21          HB2       CYS  21  13.894   4.040  20.498
  153   2HB   CYS  21          HB1       CYS  21  14.739   4.539  21.959
  154    HG   CYS  21           HG       CYS  21  15.833   2.183  21.926
  155    H    GLU  22           HN       GLU  22  11.052   3.083  23.778
  156    HA   GLU  22           HA       GLU  22  11.448   4.417  26.159
  157   1HB   GLU  22          HB2       GLU  22  10.244   2.615  27.229
  158   2HB   GLU  22          HB1       GLU  22   9.524   2.954  25.666
  159   1HG   GLU  22          HG2       GLU  22  11.377   0.661  26.288
  160   2HG   GLU  22          HG1       GLU  22   9.627   0.561  26.134
  161    H    GLU  23           HN       GLU  23  13.111   1.540  24.961
  162    HA   GLU  23           HA       GLU  23  14.465   1.057  27.427
  163   1HB   GLU  23          HB2       GLU  23  13.940  -0.645  25.623
  164   2HB   GLU  23          HB1       GLU  23  15.278   0.039  24.711
  165   1HG   GLU  23          HG2       GLU  23  16.852  -0.630  26.348
  166   2HG   GLU  23          HG1       GLU  23  15.578  -1.048  27.495
  167    H    CYS  24           HN       CYS  24  15.293   2.765  24.444
  168    HA   CYS  24           HA       CYS  24  17.985   3.276  25.193
  169   1HB   CYS  24          HB2       CYS  24  16.151   4.694  23.257
  170   2HB   CYS  24          HB1       CYS  24  17.844   5.124  23.482
  171    HG   CYS  24           HG       CYS  24  18.707   3.496  21.712
  172    H    LEU  25           HN       LEU  25  14.936   4.771  25.926
  173    HA   LEU  25           HA       LEU  25  15.932   7.228  26.906
  174   1HB   LEU  25          HB2       LEU  25  13.384   5.733  27.493
  175   2HB   LEU  25          HB1       LEU  25  13.725   7.343  28.099
  176    HG   LEU  25           HG       LEU  25  13.565   6.606  25.176
  177   1HD1  LEU  25          HD11      LEU  25  11.589   8.064  26.926
  178   2HD1  LEU  25          HD12      LEU  25  11.389   6.436  26.278
  179   3HD1  LEU  25          HD13      LEU  25  11.449   7.819  25.185
  180   1HD2  LEU  25          HD21      LEU  25  13.566   9.033  24.826
  181   2HD2  LEU  25          HD22      LEU  25  15.053   8.484  25.601
  182   3HD2  LEU  25          HD23      LEU  25  13.802   9.277  26.557
  183    H    LYS  26           HN       LYS  26  15.799   4.037  28.312
  184    HA   LYS  26           HA       LYS  26  15.898   4.977  31.033
  185   1HB   LYS  26          HB2       LYS  26  15.987   2.715  31.690
  186   2HB   LYS  26          HB1       LYS  26  14.976   2.723  30.253
  187   1HG   LYS  26          HG2       LYS  26  17.129   2.145  28.981
  188   2HG   LYS  26          HG1       LYS  26  17.787   1.742  30.567
  189   1HD   LYS  26          HD2       LYS  26  15.274   0.565  29.385
  190   2HD   LYS  26          HD1       LYS  26  16.856  -0.214  29.371
  191   1HE   LYS  26          HE2       LYS  26  16.873  -0.257  31.802
  192   2HE   LYS  26          HE1       LYS  26  15.324   0.585  31.843
  193   1HZ   LYS  26          HZ1       LYS  26  15.046  -1.794  32.163
  194   2HZ   LYS  26          HZ2       LYS  26  15.794  -2.108  30.673
  195   3HZ   LYS  26          HZ3       LYS  26  14.306  -1.295  30.719
  196    H    ILE  27           HN       ILE  27  18.146   4.605  28.526
  197    HA   ILE  27           HA       ILE  27  20.368   4.824  30.447
  198    HB   ILE  27           HB       ILE  27  21.857   4.009  28.634
  199   1HG1  ILE  27          HG12      ILE  27  19.247   3.455  27.204
  200   2HG1  ILE  27          HG11      ILE  27  20.495   4.587  26.699
  201   1HG2  ILE  27          HG21      ILE  27  21.216   1.657  28.820
  202   2HG2  ILE  27          HG22      ILE  27  19.622   2.139  29.399
  203   3HG2  ILE  27          HG23      ILE  27  21.056   2.498  30.361
  204   1HD1  ILE  27          HD11      ILE  27  22.041   2.733  26.360
  205   2HD1  ILE  27          HD12      ILE  27  20.577   2.548  25.394
  206   3HD1  ILE  27          HD13      ILE  27  20.789   1.598  26.866
  207    H    GLY  28           HN       GLY  28  18.459   6.696  28.703
  208   1HA   GLY  28          HA2       GLY  28  18.627   8.844  27.912
  209   2HA   GLY  28          HA1       GLY  28  20.199   8.911  28.694
  210    H    SER  29           HN       SER  29  18.942   6.986  25.985
  211    HA   SER  29           HA       SER  29  21.123   8.077  24.337
  212   1HB   SER  29          HB2       SER  29  20.037   5.252  24.369
  213   2HB   SER  29          HB1       SER  29  21.265   5.855  23.258
  214    HG   SER  29           HG       SER  29  21.856   6.374  25.872
  215    HA   PRO  30           HA       PRO  30  17.928   9.043  21.434
  216   1HB   PRO  30          HB2       PRO  30  19.397   9.532  19.254
  217   2HB   PRO  30          HB1       PRO  30  19.505  10.566  20.682
  218   1HG   PRO  30          HG2       PRO  30  21.349   8.401  19.767
  219   2HG   PRO  30          HG1       PRO  30  21.737   9.987  20.458
  220   1HD   PRO  30          HD2       PRO  30  21.719   7.617  21.876
  221   2HD   PRO  30          HD1       PRO  30  21.534   9.226  22.599
  222    H    TRP  31           HN       TRP  31  17.995   8.559  18.696
  223    HA   TRP  31           HA       TRP  31  18.219   5.724  18.229
  224   1HB   TRP  31          HB2       TRP  31  15.744   5.570  17.635
  225   2HB   TRP  31          HB1       TRP  31  16.125   5.628  19.353
  226    HD1  TRP  31           HD1      TRP  31  14.767   7.907  16.544
  227    HE1  TRP  31           HE1      TRP  31  13.356   9.767  17.632
  228    HE3  TRP  31           HE3      TRP  31  15.673   6.844  21.461
  229    HZ2  TRP  31           HZ2      TRP  31  12.715  10.661  20.230
  230    HZ3  TRP  31           HZ3      TRP  31  14.626   8.250  23.184
  231    HH2  TRP  31           HH2      TRP  31  13.177  10.120  22.581
  232    H    VAL  32           HN       VAL  32  17.576   5.169  15.993
  233    HA   VAL  32           HA       VAL  32  18.104   7.381  14.175
  234    HB   VAL  32           HB       VAL  32  17.794   4.436  13.546
  235   1HG1  VAL  32          HG11      VAL  32  18.873   6.707  11.879
  236   2HG1  VAL  32          HG12      VAL  32  17.346   5.864  11.623
  237   3HG1  VAL  32          HG13      VAL  32  18.871   5.005  11.420
  238   1HG2  VAL  32          HG21      VAL  32  20.279   6.097  13.953
  239   2HG2  VAL  32          HG22      VAL  32  20.253   4.438  13.355
  240   3HG2  VAL  32          HG23      VAL  32  19.703   4.794  14.993
  241    H    HIS  33           HN       HIS  33  15.831   4.620  14.030
  242    HA   HIS  33           HA       HIS  33  13.683   6.549  13.545
  243   1HB   HIS  33          HB2       HIS  33  14.284   4.122  11.854
  244   2HB   HIS  33          HB1       HIS  33  12.706   4.901  11.870
  245    HD1  HIS  33           HD1      HIS  33  12.819   7.584  11.218
  246    HD2  HIS  33           HD2      HIS  33  15.994   5.163  10.028
  247    HE1  HIS  33           HE1      HIS  33  13.990   8.844   9.386
  248    HE2  HIS  33           HE2      HIS  33  16.038   7.478   8.869
  249    H    LEU  34           HN       LEU  34  11.598   5.810  14.120
  250    HA   LEU  34           HA       LEU  34  11.709   3.683  16.145
  251   1HB   LEU  34          HB2       LEU  34  10.010   6.171  16.035
  252   2HB   LEU  34          HB1       LEU  34   9.853   4.912  17.248
  253    HG   LEU  34           HG       LEU  34  12.346   6.554  16.816
  254   1HD1  LEU  34          HD11      LEU  34  10.152   6.812  18.860
  255   2HD1  LEU  34          HD12      LEU  34  10.567   7.975  17.600
  256   3HD1  LEU  34          HD13      LEU  34  11.697   7.661  18.917
  257   1HD2  LEU  34          HD21      LEU  34  12.771   4.353  17.771
  258   2HD2  LEU  34          HD22      LEU  34  11.545   4.642  19.006
  259   3HD2  LEU  34          HD23      LEU  34  13.014   5.617  18.978
  260    H    ARG  35           HN       ARG  35  10.115   2.206  16.272
  261    HA   ARG  35           HA       ARG  35   7.952   2.321  14.305
  262   1HB   ARG  35          HB2       ARG  35   8.392  -0.289  14.160
  263   2HB   ARG  35          HB1       ARG  35   9.238   0.842  13.116
  264   1HG   ARG  35          HG2       ARG  35  10.836  -0.711  13.913
  265   2HG   ARG  35          HG1       ARG  35  11.130   0.811  14.751
  266   1HD   ARG  35          HD2       ARG  35  11.267  -0.663  16.495
  267   2HD   ARG  35          HD1       ARG  35   9.558  -0.243  16.563
  268    HE   ARG  35           HE       ARG  35   9.930  -2.508  14.921
  269   1HH1  ARG  35          HH11      ARG  35   9.849  -1.499  18.261
  270   2HH1  ARG  35          HH12      ARG  35   9.615  -3.097  18.883
  271   1HH2  ARG  35          HH21      ARG  35   9.653  -4.634  15.707
  272   2HH2  ARG  35          HH22      ARG  35   9.502  -4.899  17.414
  273    H    ILE  36           HN       ILE  36   6.022   1.622  15.023
  274    HA   ILE  36           HA       ILE  36   5.904   0.665  17.796
  275    HB   ILE  36           HB       ILE  36   4.499   2.628  17.163
  276   1HG1  ILE  36          HG12      ILE  36   2.899   0.175  17.927
  277   2HG1  ILE  36          HG11      ILE  36   3.895   1.112  19.035
  278   1HG2  ILE  36          HG21      ILE  36   3.968   2.045  14.881
  279   2HG2  ILE  36          HG22      ILE  36   2.481   2.256  15.807
  280   3HG2  ILE  36          HG23      ILE  36   3.059   0.634  15.424
  281   1HD1  ILE  36          HD11      ILE  36   1.473   2.109  17.559
  282   2HD1  ILE  36          HD12      ILE  36   2.474   3.058  18.658
  283   3HD1  ILE  36          HD13      ILE  36   1.556   1.681  19.267
  284    H    CYS  37           HN       CYS  37   4.433  -1.102  18.266
  285    HA   CYS  37           HA       CYS  37   4.601  -3.130  16.138
  286   1HB   CYS  37          HB2       CYS  37   6.096  -3.448  18.064
  287   2HB   CYS  37          HB1       CYS  37   4.713  -3.400  19.142
  288    H    ARG  38           HN       ARG  38   2.650  -3.539  15.294
  289    HA   ARG  38           HA       ARG  38   0.273  -2.513  16.462
  290   1HB   ARG  38          HB2       ARG  38   0.713  -4.285  14.064
  291   2HB   ARG  38          HB1       ARG  38  -0.852  -3.630  14.516
  292   1HG   ARG  38          HG2       ARG  38   1.581  -2.012  13.797
  293   2HG   ARG  38          HG1       ARG  38   0.207  -2.336  12.741
  294   1HD   ARG  38          HD2       ARG  38   0.195  -0.771  15.318
  295   2HD   ARG  38          HD1       ARG  38  -0.026  -0.137  13.689
  296    HE   ARG  38           HE       ARG  38  -1.956  -1.936  15.022
  297   1HH1  ARG  38          HH11      ARG  38  -1.213   0.692  12.822
  298   2HH1  ARG  38          HH12      ARG  38  -2.884   1.127  12.594
  299   1HH2  ARG  38          HH21      ARG  38  -4.150  -1.358  14.704
  300   2HH2  ARG  38          HH22      ARG  38  -4.542  -0.032  13.656
  301    H    THR  39           HN       THR  39   1.792  -5.108  17.563
  302    HA   THR  39           HA       THR  39  -0.648  -6.717  17.857
  303    HB   THR  39           HB       THR  39   2.158  -7.589  18.540
  304    HG1  THR  39           HG1      THR  39   0.689  -7.904  16.101
  305   1HG2  THR  39          HG21      THR  39   1.205  -9.839  18.298
  306   2HG2  THR  39          HG22      THR  39  -0.371  -9.134  17.936
  307   3HG2  THR  39          HG23      THR  39   0.347  -8.915  19.532
  308    H    CYS  40           HN       CYS  40   1.661  -4.802  19.620
  309    HA   CYS  40           HA       CYS  40   0.252  -5.430  22.107
  310   1HB   CYS  40          HB2       CYS  40   2.279  -5.918  23.322
  311   2HB   CYS  40          HB1       CYS  40   2.220  -6.959  21.903
  312    H    GLY  41           HN       GLY  41   1.525  -3.112  20.078
  313   1HA   GLY  41          HA2       GLY  41   1.584  -0.827  20.294
  314   2HA   GLY  41          HA1       GLY  41   0.943  -1.022  21.916
  315    H    HIS  42           HN       HIS  42   3.898  -2.664  21.123
  316    HA   HIS  42           HA       HIS  42   5.304  -0.878  22.965
  317   1HB   HIS  42          HB2       HIS  42   5.338  -3.515  23.003
  318   2HB   HIS  42          HB1       HIS  42   6.568  -3.315  21.761
  319    HD1  HIS  42           HD1      HIS  42   8.660  -1.644  22.595
  320    HD2  HIS  42           HD2      HIS  42   6.306  -3.459  25.515
  321    HE1  HIS  42           HE1      HIS  42  10.034  -1.619  24.698
  322    HE2  HIS  42           HE2      HIS  42   8.579  -2.675  26.467
  323    H    VAL  43           HN       VAL  43   6.911   0.453  22.337
  324    HA   VAL  43           HA       VAL  43   7.339   0.765  19.468
  325    HB   VAL  43           HB       VAL  43   8.459   2.557  21.623
  326   1HG1  VAL  43          HG11      VAL  43   9.295   3.184  19.524
  327   2HG1  VAL  43          HG12      VAL  43   7.962   4.296  19.822
  328   3HG1  VAL  43          HG13      VAL  43   7.739   2.928  18.733
  329   1HG2  VAL  43          HG21      VAL  43   5.666   2.676  20.494
  330   2HG2  VAL  43          HG22      VAL  43   6.409   3.904  21.519
  331   3HG2  VAL  43          HG23      VAL  43   6.106   2.287  22.156
  332    H    GLY  44           HN       GLY  44   9.796   1.574  19.056
  333   1HA   GLY  44          HA2       GLY  44  11.898   0.860  20.691
  334   2HA   GLY  44          HA1       GLY  44  11.558  -0.555  19.700
  335    H    CYS  45           HN       CYS  45  13.953   1.083  19.666
  336    HA   CYS  45           HA       CYS  45  13.872   2.584  17.220
  337   1HB   CYS  45          HB2       CYS  45  16.328   2.712  17.486
  338   2HB   CYS  45          HB1       CYS  45  15.475   3.200  18.945
  339    HG   CYS  45           HG       CYS  45  17.909   1.690  19.393
  340    H    CYS  46           HN       CYS  46  14.511   1.955  15.208
  341    HA   CYS  46           HA       CYS  46  14.250  -0.763  14.518
  342   1HB   CYS  46          HB2       CYS  46  14.971  -0.004  12.256
  343   2HB   CYS  46          HB1       CYS  46  13.674   0.969  12.942
  344    HG   CYS  46           HG       CYS  46  16.314   2.048  11.585
  345    H    ASP  47           HN       ASP  47  16.011  -1.815  13.017
  346    HA   ASP  47           HA       ASP  47  18.232  -2.291  14.775
  347   1HB   ASP  47          HB2       ASP  47  18.835  -4.080  13.260
  348   2HB   ASP  47          HB1       ASP  47  17.103  -4.130  13.565
  349    H    ASP  48           HN       ASP  48  17.693   0.000  12.462
  350    HA   ASP  48           HA       ASP  48  20.321   0.266  11.383
  351   1HB   ASP  48          HB2       ASP  48  18.286   2.467  11.806
  352   2HB   ASP  48          HB1       ASP  48  19.627   2.468  10.667
  353    H    SER  49           HN       SER  49  18.816   0.975  14.362
  354    HA   SER  49           HA       SER  49  20.922   2.743  15.301
  355   1HB   SER  49          HB2       SER  49  18.641   3.160  16.077
  356   2HB   SER  49          HB1       SER  49  18.515   1.510  16.679
  357    HG   SER  49           HG       SER  49  20.094   3.647  17.671
  358    HA   PRO  50           HA       PRO  50  23.574  -0.549  16.619
  359   1HB   PRO  50          HB2       PRO  50  24.706   0.647  18.828
  360   2HB   PRO  50          HB1       PRO  50  25.210   0.938  17.160
  361   1HG   PRO  50          HG2       PRO  50  23.400   2.557  18.906
  362   2HG   PRO  50          HG1       PRO  50  24.658   3.104  17.781
  363   1HD   PRO  50          HD2       PRO  50  22.059   3.206  17.133
  364   2HD   PRO  50          HD1       PRO  50  23.300   2.815  15.926
  365    H    HIS  51           HN       HIS  51  21.059   0.680  18.577
  366    HA   HIS  51           HA       HIS  51  21.433  -1.198  20.748
  367   1HB   HIS  51          HB2       HIS  51  20.423   1.141  20.955
  368   2HB   HIS  51          HB1       HIS  51  18.983   0.478  20.194
  369    HD1  HIS  51           HD1      HIS  51  20.501   1.008  23.423
  370    HD2  HIS  51           HD2      HIS  51  17.854  -1.754  21.793
  371    HE1  HIS  51           HE1      HIS  51  19.330  -0.051  25.385
  372    HE2  HIS  51           HE2      HIS  51  17.852  -1.841  24.379
  373    H    LYS  52           HN       LYS  52  19.424  -0.833  17.893
  374    HA   LYS  52           HA       LYS  52  17.914  -2.161  16.836
  375   1HB   LYS  52          HB2       LYS  52  19.751  -4.352  17.818
  376   2HB   LYS  52          HB1       LYS  52  18.657  -4.447  16.443
  377   1HG   LYS  52          HG2       LYS  52  19.935  -2.558  15.417
  378   2HG   LYS  52          HG1       LYS  52  21.104  -2.730  16.723
  379   1HD   LYS  52          HD2       LYS  52  21.524  -5.046  16.023
  380   2HD   LYS  52          HD1       LYS  52  20.369  -4.846  14.700
  381   1HE   LYS  52          HE2       LYS  52  21.761  -2.930  13.892
  382   2HE   LYS  52          HE1       LYS  52  22.958  -3.358  15.111
  383   1HZ   LYS  52          HZ1       LYS  52  22.044  -5.089  12.879
  384   2HZ   LYS  52          HZ2       LYS  52  23.181  -5.534  14.063
  385   3HZ   LYS  52          HZ3       LYS  52  23.531  -4.280  12.971
  386    H    HIS  53           HN       HIS  53  16.631  -1.487  19.026
  387    HA   HIS  53           HA       HIS  53  15.945  -3.766  20.650
  388   1HB   HIS  53          HB2       HIS  53  15.928  -1.352  21.463
  389   2HB   HIS  53          HB1       HIS  53  14.440  -1.144  20.543
  390    HD1  HIS  53           HD1      HIS  53  13.006  -0.759  22.697
  391    HD2  HIS  53           HD2      HIS  53  15.000  -4.411  22.587
  392    HE1  HIS  53           HE1      HIS  53  12.010  -2.134  24.544
  393    HE2  HIS  53           HE2      HIS  53  13.415  -4.230  24.613
  394    H    ALA  54           HN       ALA  54  14.910  -2.475  17.678
  395    HA   ALA  54           HA       ALA  54  12.212  -3.334  17.683
  396   1HB   ALA  54          HB1       ALA  54  13.034  -1.675  16.112
  397   2HB   ALA  54          HB2       ALA  54  12.337  -3.049  15.253
  398   3HB   ALA  54          HB3       ALA  54  14.089  -2.880  15.368
  399    H    THR  55           HN       THR  55  15.193  -4.813  16.469
  400    HA   THR  55           HA       THR  55  13.902  -7.118  15.418
  401    HB   THR  55           HB       THR  55  16.358  -7.981  15.460
  402    HG1  THR  55           HG1      THR  55  17.826  -6.597  16.165
  403   1HG2  THR  55          HG21      THR  55  16.876  -6.671  13.456
  404   2HG2  THR  55          HG22      THR  55  15.599  -5.527  13.867
  405   3HG2  THR  55          HG23      THR  55  15.191  -7.192  13.450
  406    H    ARG  56           HN       ARG  56  15.718  -6.429  18.378
  407    HA   ARG  56           HA       ARG  56  15.714  -9.014  19.445
  408   1HB   ARG  56          HB2       ARG  56  15.651  -6.372  20.915
  409   2HB   ARG  56          HB1       ARG  56  16.050  -7.924  21.639
  410   1HG   ARG  56          HG2       ARG  56  17.968  -8.109  20.095
  411   2HG   ARG  56          HG1       ARG  56  17.591  -6.497  19.484
  412   1HD   ARG  56          HD2       ARG  56  17.877  -5.610  21.776
  413   2HD   ARG  56          HD1       ARG  56  18.354  -7.222  22.312
  414    HE   ARG  56           HE       ARG  56  19.863  -5.562  20.396
  415   1HH1  ARG  56          HH11      ARG  56  19.718  -8.094  22.819
  416   2HH1  ARG  56          HH12      ARG  56  21.444  -8.321  22.859
  417   1HH2  ARG  56          HH21      ARG  56  22.122  -5.866  20.444
  418   2HH2  ARG  56          HH22      ARG  56  22.808  -7.064  21.501
  419    H    HIS  57           HN       HIS  57  13.266  -6.482  19.521
  420    HA   HIS  57           HA       HIS  57  11.554  -7.701  21.401
  421   1HB   HIS  57          HB2       HIS  57  11.277  -5.352  20.750
  422   2HB   HIS  57          HB1       HIS  57  10.843  -5.846  19.116
  423    HD1  HIS  57           HD1      HIS  57   9.507  -5.869  22.653
  424    HD2  HIS  57           HD2      HIS  57   8.232  -6.645  18.760
  425    HE1  HIS  57           HE1      HIS  57   7.000  -6.202  22.767
  426    H    PHE  58           HN       PHE  58  11.687  -7.884  17.861
  427    HA   PHE  58           HA       PHE  58   9.462  -9.577  17.529
  428   1HB   PHE  58          HB2       PHE  58  10.351  -8.429  15.615
  429   2HB   PHE  58          HB1       PHE  58  11.932  -9.166  15.838
  430    HD1  PHE  58           HD1      PHE  58   8.473 -10.582  15.719
  431    HD2  PHE  58           HD2      PHE  58  12.388 -10.542  14.079
  432    HE1  PHE  58           HE1      PHE  58   7.853 -12.417  14.203
  433    HE2  PHE  58           HE2      PHE  58  11.783 -12.376  12.558
  434    HZ   PHE  58           HZ       PHE  58   9.509 -13.318  12.620
  435    H    HIS  59           HN       HIS  59  12.902 -10.244  17.940
  436    HA   HIS  59           HA       HIS  59  12.760 -13.042  17.691
  437   1HB   HIS  59          HB2       HIS  59  14.846 -11.769  17.502
  438   2HB   HIS  59          HB1       HIS  59  14.743 -11.324  19.199
  439    HD1  HIS  59           HD1      HIS  59  15.017 -14.502  17.111
  440    HD2  HIS  59           HD2      HIS  59  16.142 -12.973  20.816
  441    HE1  HIS  59           HE1      HIS  59  16.468 -16.267  18.166
  442    HE2  HIS  59           HE2      HIS  59  17.273 -15.248  20.328
  443    H    ALA  60           HN       ALA  60  12.098 -10.906  20.367
  444    HA   ALA  60           HA       ALA  60  12.198 -13.021  22.339
  445   1HB   ALA  60          HB1       ALA  60  11.330 -10.146  22.606
  446   2HB   ALA  60          HB2       ALA  60  12.941 -10.784  22.939
  447   3HB   ALA  60          HB3       ALA  60  11.572 -11.280  23.934
  448    H    THR  61           HN       THR  61   9.647 -10.892  21.023
  449    HA   THR  61           HA       THR  61   7.645 -12.400  22.505
  450    HB   THR  61           HB       THR  61   6.051 -10.683  21.576
  451    HG1  THR  61           HG1      THR  61   8.497  -9.576  20.605
  452   1HG2  THR  61          HG21      THR  61   7.067 -10.473  23.807
  453   2HG2  THR  61          HG22      THR  61   6.804  -8.901  23.051
  454   3HG2  THR  61          HG23      THR  61   8.425  -9.598  23.095
  455    H    GLY  62           HN       GLY  62   8.730 -12.004  19.209
  456   1HA   GLY  62          HA2       GLY  62   8.169 -13.275  17.350
  457   2HA   GLY  62          HA1       GLY  62   6.972 -14.117  18.325
  458    H    HIS  63           HN       HIS  63   7.407 -10.680  17.559
  459    HA   HIS  63           HA       HIS  63   4.670 -10.677  16.464
  460   1HB   HIS  63          HB2       HIS  63   6.156  -8.475  17.921
  461   2HB   HIS  63          HB1       HIS  63   4.633  -8.230  17.076
  462    HD2  HIS  63           HD2      HIS  63   3.766 -11.378  18.518
  463    HE1  HIS  63           HE1      HIS  63   3.331  -8.707  21.776
  464    HE2  HIS  63           HE2      HIS  63   2.583 -10.928  20.785
  465    HA   PRO  64           HA       PRO  64   7.479  -9.951  13.019
  466   1HB   PRO  64          HB2       PRO  64   5.992 -11.059  11.099
  467   2HB   PRO  64          HB1       PRO  64   6.783 -12.041  12.338
  468   1HG   PRO  64          HG2       PRO  64   3.929 -11.148  12.167
  469   2HG   PRO  64          HG1       PRO  64   4.578 -12.740  12.603
  470   1HD   PRO  64          HD2       PRO  64   3.756 -10.864  14.428
  471   2HD   PRO  64          HD1       PRO  64   4.959 -12.123  14.771
  472    H    ILE  65           HN       ILE  65   4.733  -8.205  13.694
  473    HA   ILE  65           HA       ILE  65   5.096  -6.690  11.200
  474    HB   ILE  65           HB       ILE  65   2.470  -7.189  12.597
  475   1HG1  ILE  65          HG12      ILE  65   3.520  -7.842   9.835
  476   2HG1  ILE  65          HG11      ILE  65   3.133  -8.989  11.113
  477   1HG2  ILE  65          HG21      ILE  65   3.079  -5.308  10.313
  478   2HG2  ILE  65          HG22      ILE  65   2.587  -4.847  11.942
  479   3HG2  ILE  65          HG23      ILE  65   1.465  -5.719  10.898
  480   1HD1  ILE  65          HD11      ILE  65   1.165  -7.225   9.678
  481   2HD1  ILE  65          HD12      ILE  65   0.782  -8.406  10.932
  482   3HD1  ILE  65          HD13      ILE  65   1.428  -8.943   9.380
  483    H    ILE  66           HN       ILE  66   5.574  -4.661  11.384
  484    HA   ILE  66           HA       ILE  66   4.958  -3.245  13.886
  485    HB   ILE  66           HB       ILE  66   7.072  -1.978  13.646
  486   1HG1  ILE  66          HG12      ILE  66   7.808  -4.098  11.616
  487   2HG1  ILE  66          HG11      ILE  66   7.379  -2.440  11.211
  488   1HG2  ILE  66          HG21      ILE  66   7.385  -4.959  13.937
  489   2HG2  ILE  66          HG22      ILE  66   6.919  -3.826  15.206
  490   3HG2  ILE  66          HG23      ILE  66   8.534  -3.746  14.502
  491   1HD1  ILE  66          HD11      ILE  66   9.308  -1.635  12.465
  492   2HD1  ILE  66          HD12      ILE  66   9.782  -2.762  11.193
  493   3HD1  ILE  66          HD13      ILE  66   9.734  -3.298  12.874
  494    H    GLU  67           HN       GLU  67   5.303  -0.805  13.485
  495    HA   GLU  67           HA       GLU  67   4.335  -0.061  10.823
  496   1HB   GLU  67          HB2       GLU  67   2.382  -0.435  12.248
  497   2HB   GLU  67          HB1       GLU  67   3.039   0.655  13.457
  498   1HG   GLU  67          HG2       GLU  67   2.815   2.521  11.923
  499   2HG   GLU  67          HG1       GLU  67   2.200   1.431  10.675
  500    H    GLY  68           HN       GLY  68   4.784   2.081  10.244
  501   1HA   GLY  68          HA2       GLY  68   7.149   3.175  11.367
  502   2HA   GLY  68          HA1       GLY  68   6.144   3.930  10.141
  503    H    TYR  69           HN       TYR  69   7.074   3.904  13.408
  504    HA   TYR  69           HA       TYR  69   4.872   5.567  14.310
  505   1HB   TYR  69          HB2       TYR  69   6.012   3.796  15.742
  506   2HB   TYR  69          HB1       TYR  69   7.401   4.873  15.816
  507    HD1  TYR  69           HD1      TYR  69   4.101   4.152  17.101
  508    HD2  TYR  69           HD2      TYR  69   7.175   7.087  16.961
  509    HE1  TYR  69           HE1      TYR  69   3.096   5.288  19.035
  510    HE2  TYR  69           HE2      TYR  69   6.178   8.230  18.895
  511    HH   TYR  69           HH       TYR  69   4.060   6.883  20.936
  512    H    ASP  70           HN       ASP  70   8.355   5.828  13.706
  513    HA   ASP  70           HA       ASP  70   8.392   8.645  14.238
  514   1HB   ASP  70          HB2       ASP  70  10.439   7.564  14.684
  515   2HB   ASP  70          HB1       ASP  70  10.459   6.760  13.121
  516    HA   PRO  71           HA       PRO  71   8.373   9.150   9.520
  517   1HB   PRO  71          HB2       PRO  71   8.038   6.653   8.140
  518   2HB   PRO  71          HB1       PRO  71   9.430   7.735   8.103
  519   1HG   PRO  71          HG2       PRO  71   9.456   5.221   9.215
  520   2HG   PRO  71          HG1       PRO  71  10.563   6.527   9.674
  521   1HD   PRO  71          HD2       PRO  71   8.060   5.595  11.034
  522   2HD   PRO  71          HD1       PRO  71   9.613   6.082  11.741
  523    HA   PRO  72           HA       PRO  72   3.934   8.559  10.136
  524   1HB   PRO  72          HB2       PRO  72   3.570  11.242   9.148
  525   2HB   PRO  72          HB1       PRO  72   3.426  10.656  10.805
  526   1HG   PRO  72          HG2       PRO  72   5.394  12.359   9.952
  527   2HG   PRO  72          HG1       PRO  72   5.558  11.270  11.341
  528   1HD   PRO  72          HD2       PRO  72   6.565  10.938   8.540
  529   2HD   PRO  72          HD1       PRO  72   7.363  10.548  10.080
  530    H    GLU  73           HN       GLU  73   5.234   7.685   7.697
  531    HA   GLU  73           HA       GLU  73   3.671   8.748   5.503
  532   1HB   GLU  73          HB2       GLU  73   5.551   6.379   5.571
  533   2HB   GLU  73          HB1       GLU  73   4.912   7.157   4.131
  534   1HG   GLU  73          HG2       GLU  73   6.137   9.169   4.615
  535   2HG   GLU  73          HG1       GLU  73   6.681   8.507   6.156
  536    H    GLY  74           HN       GLY  74   3.273   6.454   7.921
  537   1HA   GLY  74          HA2       GLY  74   1.530   5.018   8.365
  538   2HA   GLY  74          HA1       GLY  74   0.755   5.602   6.900
  539    H    TRP  75           HN       TRP  75   3.249   3.403   8.094
  540    HA   TRP  75           HA       TRP  75   2.616   1.596   5.896
  541   1HB   TRP  75          HB2       TRP  75   5.056   1.207   5.486
  542   2HB   TRP  75          HB1       TRP  75   4.487   2.799   4.999
  543    HD1  TRP  75           HD1      TRP  75   5.280   4.892   6.516
  544    HE1  TRP  75           HE1      TRP  75   7.343   5.200   8.015
  545    HE3  TRP  75           HE3      TRP  75   6.631  -0.010   7.057
  546    HZ2  TRP  75           HZ2      TRP  75   9.287   3.583   9.266
  547    HZ3  TRP  75           HZ3      TRP  75   8.607  -0.540   8.425
  548    HH2  TRP  75           HH2      TRP  75   9.905   1.219   9.504
  549    H    GLY  76           HN       GLY  76   3.044  -0.552   6.293
  550   1HA   GLY  76          HA2       GLY  76   3.880  -1.186   9.054
  551   2HA   GLY  76          HA1       GLY  76   2.637  -2.086   8.195
  552    H    TRP  77           HN       TRP  77   5.476  -2.591   9.321
  553    HA   TRP  77           HA       TRP  77   6.620  -3.796   6.891
  554   1HB   TRP  77          HB2       TRP  77   8.094  -2.167   7.948
  555   2HB   TRP  77          HB1       TRP  77   7.957  -3.002   9.488
  556    HD1  TRP  77           HD1      TRP  77   9.697  -4.867   9.962
  557    HE1  TRP  77           HE1      TRP  77  11.601  -5.959   8.606
  558    HE3  TRP  77           HE3      TRP  77   8.661  -2.876   5.374
  559    HZ2  TRP  77           HZ2      TRP  77  12.520  -5.976   5.941
  560    HZ3  TRP  77           HZ3      TRP  77  10.098  -3.481   3.473
  561    HH2  TRP  77           HH2      TRP  77  11.988  -4.998   3.752
  562    H    CYS  78           HN       CYS  78   6.586  -5.915   6.730
  563    HA   CYS  78           HA       CYS  78   5.937  -7.497   9.127
  564   1HB   CYS  78          HB2       CYS  78   4.463  -7.523   7.011
  565   2HB   CYS  78          HB1       CYS  78   5.760  -8.439   6.267
  566    H    TYR  79           HN       TYR  79   7.770  -8.233  10.048
  567    HA   TYR  79           HA       TYR  79  10.297  -8.288   8.937
  568   1HB   TYR  79          HB2       TYR  79   9.150  -9.931  11.193
  569   2HB   TYR  79          HB1       TYR  79  10.858  -9.934  10.779
  570    HD1  TYR  79           HD1      TYR  79  12.020  -7.599  10.743
  571    HD2  TYR  79           HD2      TYR  79   8.357  -8.400  12.752
  572    HE1  TYR  79           HE1      TYR  79  12.391  -5.645  12.187
  573    HE2  TYR  79           HE2      TYR  79   8.714  -6.445  14.194
  574    HH   TYR  79           HH       TYR  79  11.233  -4.148  13.574
  575    H    VAL  80           HN       VAL  80   8.154 -11.097   9.366
  576    HA   VAL  80           HA       VAL  80   9.953 -12.940   8.219
  577    HB   VAL  80           HB       VAL  80   8.006 -14.499   8.154
  578   1HG1  VAL  80          HG11      VAL  80   8.448 -12.974  10.718
  579   2HG1  VAL  80          HG12      VAL  80   9.386 -14.349  10.137
  580   3HG1  VAL  80          HG13      VAL  80   7.698 -14.565  10.601
  581   1HG2  VAL  80          HG21      VAL  80   5.893 -13.785   9.159
  582   2HG2  VAL  80          HG22      VAL  80   6.242 -12.872   7.691
  583   3HG2  VAL  80          HG23      VAL  80   6.500 -12.133   9.271
  584    H    ASP  81           HN       ASP  81   7.797 -10.720   6.769
  585    HA   ASP  81           HA       ASP  81   7.715 -12.202   4.241
  586   1HB   ASP  81          HB2       ASP  81   6.368  -9.615   5.045
  587   2HB   ASP  81          HB1       ASP  81   6.185 -10.401   3.485
  588    H    GLU  82           HN       GLU  82   9.021  -9.356   5.747
  589    HA   GLU  82           HA       GLU  82  10.472  -7.749   5.141
  590   1HB   GLU  82          HB2       GLU  82  11.162  -9.711   2.958
  591   2HB   GLU  82          HB1       GLU  82  11.993  -8.175   3.166
  592   1HG   GLU  82          HG2       GLU  82  12.429  -8.960   5.565
  593   2HG   GLU  82          HG1       GLU  82  11.972 -10.558   4.975
  594    H    VAL  83           HN       VAL  83   7.743  -7.722   4.252
  595    HA   VAL  83           HA       VAL  83   8.053  -5.960   1.920
  596    HB   VAL  83           HB       VAL  83   5.717  -6.384   1.328
  597   1HG1  VAL  83          HG11      VAL  83   7.468  -7.736   0.305
  598   2HG1  VAL  83          HG12      VAL  83   5.975  -8.657   0.488
  599   3HG1  VAL  83          HG13      VAL  83   7.317  -8.923   1.602
  600   1HG2  VAL  83          HG21      VAL  83   5.752  -8.380   3.588
  601   2HG2  VAL  83          HG22      VAL  83   4.469  -8.224   2.389
  602   3HG2  VAL  83          HG23      VAL  83   4.797  -6.901   3.507
  603    H    MET  84           HN       MET  84   7.229  -3.959   2.000
  604    HA   MET  84           HA       MET  84   6.066  -3.075   4.557
  605   1HB   MET  84          HB2       MET  84   8.170  -1.983   3.910
  606   2HB   MET  84          HB1       MET  84   7.454  -1.494   2.383
  607   1HG   MET  84          HG2       MET  84   5.830  -0.118   3.599
  608   2HG   MET  84          HG1       MET  84   6.593  -0.585   5.120
  609   1HE   MET  84          HE1       MET  84   7.173   1.239   1.652
  610   2HE   MET  84          HE2       MET  84   8.473   0.051   1.751
  611   3HE   MET  84          HE3       MET  84   8.845   1.772   1.844
  612    H    PHE  85           HN       PHE  85   3.933  -2.790   4.533
  613    HA   PHE  85           HA       PHE  85   2.659  -2.154   1.959
  614   1HB   PHE  85          HB2       PHE  85   0.563  -3.084   3.061
  615   2HB   PHE  85          HB1       PHE  85   1.825  -4.244   2.670
  616    HD1  PHE  85           HD1      PHE  85   0.216  -2.378   5.411
  617    HD2  PHE  85           HD2      PHE  85   2.893  -5.511   4.353
  618    HE1  PHE  85           HE1      PHE  85   0.190  -3.179   7.733
  619    HE2  PHE  85           HE2      PHE  85   2.872  -6.320   6.675
  620    HZ   PHE  85           HZ       PHE  85   1.519  -5.154   8.371
  621    H    ASP  86           HN       ASP  86   0.500  -0.991   2.250
  622    HA   ASP  86           HA       ASP  86   1.127   1.502   3.568
  623   1HB   ASP  86          HB2       ASP  86   0.259   1.706   1.363
  624   2HB   ASP  86          HB1       ASP  86  -1.092   0.634   1.718
  625    H    LEU  87           HN       LEU  87   0.286   2.271   5.382
  626    HA   LEU  87           HA       LEU  87  -2.169   1.074   6.472
  627   1HB   LEU  87          HB2       LEU  87   0.453   1.466   7.891
  628   2HB   LEU  87          HB1       LEU  87  -1.059   1.413   8.774
  629    HG   LEU  87           HG       LEU  87   0.052  -0.812   7.061
  630   1HD1  LEU  87          HD11      LEU  87  -0.172  -0.518  10.054
  631   2HD1  LEU  87          HD12      LEU  87   1.319  -0.503   9.112
  632   3HD1  LEU  87          HD13      LEU  87   0.348  -1.972   9.202
  633   1HD2  LEU  87          HD21      LEU  87  -2.392  -0.722   8.829
  634   2HD2  LEU  87          HD22      LEU  87  -1.779  -2.141   7.979
  635   3HD2  LEU  87          HD23      LEU  87  -2.395  -0.763   7.066
  636    H    SER  88           HN       SER  88  -1.341   3.654   5.087
  637    HA   SER  88           HA       SER  88  -0.998   5.767   6.834
  638   1HB   SER  88          HB2       SER  88  -0.749   5.888   4.374
  639   2HB   SER  88          HB1       SER  88  -2.503   5.829   4.214
  640    HG   SER  88           HG       SER  88  -1.768   7.966   4.138
  641    H    ASP  89           HN       ASP  89  -4.047   4.309   5.772
  642    HA   ASP  89           HA       ASP  89  -5.629   6.355   7.064
  643   1HB   ASP  89          HB2       ASP  89  -6.402   3.765   5.715
  644   2HB   ASP  89          HB1       ASP  89  -7.560   4.907   6.381
  645    H    ARG  90           HN       ARG  90  -4.093   3.546   8.128
  646    HA   ARG  90           HA       ARG  90  -6.029   3.230  10.325
  647   1HB   ARG  90          HB2       ARG  90  -4.627   1.017   8.818
  648   2HB   ARG  90          HB1       ARG  90  -5.645   0.790  10.235
  649   1HG   ARG  90          HG2       ARG  90  -7.563   1.643   9.024
  650   2HG   ARG  90          HG1       ARG  90  -6.554   1.954   7.611
  651   1HD   ARG  90          HD2       ARG  90  -6.096  -0.433   7.405
  652   2HD   ARG  90          HD1       ARG  90  -7.072  -0.752   8.840
  653    HE   ARG  90           HE       ARG  90  -8.928   0.346   7.434
  654   1HH1  ARG  90          HH11      ARG  90  -6.355  -1.655   6.140
  655   2HH1  ARG  90          HH12      ARG  90  -7.307  -2.216   4.792
  656   1HH2  ARG  90          HH21      ARG  90 -10.164  -0.367   5.682
  657   2HH2  ARG  90          HH22      ARG  90  -9.474  -1.473   4.524
  658    H    MET  91           HN       MET  91  -3.204   4.438   9.870
  659    HA   MET  91           HA       MET  91  -1.480   2.831  11.486
  660   1HB   MET  91          HB2       MET  91   0.121   4.640  11.304
  661   2HB   MET  91          HB1       MET  91  -0.600   4.325   9.733
  662   1HG   MET  91          HG2       MET  91  -2.037   6.258   9.972
  663   2HG   MET  91          HG1       MET  91  -1.400   6.554  11.589
  664   1HE   MET  91          HE1       MET  91   1.709   5.890  11.169
  665   2HE   MET  91          HE2       MET  91   1.092   7.264  12.087
  666   3HE   MET  91          HE3       MET  91   2.318   7.513  10.844
  667    H    THR  92           HN       THR  92  -0.419   3.677  13.450
  668    HA   THR  92           HA       THR  92  -2.478   4.463  15.330
  669    HB   THR  92           HB       THR  92   0.414   3.952  15.998
  670    HG1  THR  92           HG1      THR  92  -0.252   2.188  14.750
  671   1HG2  THR  92          HG21      THR  92  -1.018   4.792  17.792
  672   2HG2  THR  92          HG22      THR  92  -0.553   3.119  18.099
  673   3HG2  THR  92          HG23      THR  92  -2.169   3.488  17.497
  674    HA   PRO  93           HA       PRO  93  -1.179   8.757  15.252
  675   1HB   PRO  93          HB2       PRO  93  -2.837   9.574  17.250
  676   2HB   PRO  93          HB1       PRO  93  -3.381   9.321  15.588
  677   1HG   PRO  93          HG2       PRO  93  -3.638   7.520  17.961
  678   2HG   PRO  93          HG1       PRO  93  -4.825   7.882  16.695
  679   1HD   PRO  93          HD2       PRO  93  -3.351   5.608  16.713
  680   2HD   PRO  93          HD1       PRO  93  -3.883   6.392  15.213
  681    H    HIS  94           HN       HIS  94   0.514   9.631  16.256
  682    HA   HIS  94           HA       HIS  94   1.582   8.435  18.635
  683   1HB   HIS  94          HB2       HIS  94   3.385  10.106  18.428
  684   2HB   HIS  94          HB1       HIS  94   3.108   9.257  16.914
  685    HD1  HIS  94           HD1      HIS  94   1.997  10.641  14.969
  686    HD2  HIS  94           HD2      HIS  94   2.996  12.849  18.353
  687    HE1  HIS  94           HE1      HIS  94   1.916  13.055  14.258
  688    HE2  HIS  94           HE2      HIS  94   2.346  14.372  16.367
  689    H    ASN  95           HN       ASN  95   1.313   9.053  20.689
  690    HA   ASN  95           HA       ASN  95  -0.537  11.259  21.164
  691   1HB   ASN  95          HB2       ASN  95  -0.773  10.321  23.434
  692   2HB   ASN  95          HB1       ASN  95  -1.118   9.130  22.188
  693   1HD2  ASN  95          HD21      ASN  95   0.200   7.360  21.968
  694   2HD2  ASN  95          HD22      ASN  95   1.423   6.948  23.120
  695    H    GLY  96           HN       GLY  96   2.479  11.391  20.639
  696   1HA   GLY  96          HA2       GLY  96   2.930  13.654  22.298
  697   2HA   GLY  96          HA1       GLY  96   3.884  12.278  22.838
  698    HA   PRO  97           HA       PRO  97   5.839  14.418  19.087
  699   1HB   PRO  97          HB2       PRO  97   7.464  16.237  20.204
  700   2HB   PRO  97          HB1       PRO  97   5.767  16.595  19.862
  701   1HG   PRO  97          HG2       PRO  97   7.060  15.848  22.455
  702   2HG   PRO  97          HG1       PRO  97   5.819  17.074  22.134
  703   1HD   PRO  97          HD2       PRO  97   5.288  14.573  23.133
  704   2HD   PRO  97          HD1       PRO  97   4.121  15.546  22.217
  705    H    ILE  98           HN       ILE  98   7.947  14.037  18.341
  706    HA   ILE  98           HA       ILE  98   9.634  12.449  20.171
  707    HB   ILE  98           HB       ILE  98   9.276  12.122  17.185
  708   1HG1  ILE  98          HG12      ILE  98   8.548  10.276  19.472
  709   2HG1  ILE  98          HG11      ILE  98   7.405  11.264  18.565
  710   1HG2  ILE  98          HG21      ILE  98  10.777  10.210  17.369
  711   2HG2  ILE  98          HG22      ILE  98  11.011  10.545  19.084
  712   3HG2  ILE  98          HG23      ILE  98  11.587  11.693  17.876
  713   1HD1  ILE  98          HD11      ILE  98   9.102   9.056  17.431
  714   2HD1  ILE  98          HD12      ILE  98   7.926  10.025  16.542
  715   3HD1  ILE  98          HD13      ILE  98   7.389   8.945  17.830
  716    HA   PRO  99           HA       PRO  99  12.657  15.706  19.490
  717   1HB   PRO  99          HB2       PRO  99  14.471  13.582  20.498
  718   2HB   PRO  99          HB1       PRO  99  14.260  15.242  21.063
  719   1HG   PRO  99          HG2       PRO  99  13.296  13.187  22.462
  720   2HG   PRO  99          HG1       PRO  99  12.401  14.713  22.339
  721   1HD   PRO  99          HD2       PRO  99  11.933  12.119  20.931
  722   2HD   PRO  99          HD1       PRO  99  10.756  13.283  21.573
  723    H    ARG 100           HN       ARG 100  13.812  16.152  17.705
  724    HA   ARG 100           HA       ARG 100  14.121  14.025  15.751
  725   1HB   ARG 100          HB2       ARG 100  13.235  16.407  15.289
  726   2HB   ARG 100          HB1       ARG 100  14.926  16.893  15.333
  727   1HG   ARG 100          HG2       ARG 100  14.413  16.536  13.063
  728   2HG   ARG 100          HG1       ARG 100  15.341  15.121  13.572
  729   1HD   ARG 100          HD2       ARG 100  12.726  14.440  14.144
  730   2HD   ARG 100          HD1       ARG 100  12.606  15.310  12.617
  731    HE   ARG 100           HE       ARG 100  14.572  13.634  12.030
  732   1HH1  ARG 100          HH11      ARG 100  11.557  13.071  13.721
  733   2HH1  ARG 100          HH12      ARG 100  11.463  11.391  13.273
  734   1HH2  ARG 100          HH21      ARG 100  14.421  11.448  11.385
  735   2HH2  ARG 100          HH22      ARG 100  13.078  10.480  11.923
  736    H    TYR 101           HN       TYR 101  15.875  12.780  16.094
  737    HA   TYR 101           HA       TYR 101  18.431  14.106  16.649
  738   1HB   TYR 101          HB2       TYR 101  17.657  11.189  16.847
  739   2HB   TYR 101          HB1       TYR 101  19.259  11.832  17.200
  740    HD1  TYR 101           HD1      TYR 101  19.246  13.832  18.962
  741    HD2  TYR 101           HD2      TYR 101  16.218  10.862  18.621
  742    HE1  TYR 101           HE1      TYR 101  18.567  14.267  21.283
  743    HE2  TYR 101           HE2      TYR 101  15.530  11.292  20.943
  744    HH   TYR 101           HH       TYR 101  16.528  14.007  22.680
  745    H    VAL 102           HN       VAL 102  16.676  12.869  14.091
  746    HA   VAL 102           HA       VAL 102  19.094  12.722  12.456
  747    HB   VAL 102           HB       VAL 102  17.960  10.841  11.136
  748   1HG1  VAL 102          HG11      VAL 102  18.857   9.102  12.644
  749   2HG1  VAL 102          HG12      VAL 102  19.007  10.314  13.917
  750   3HG1  VAL 102          HG13      VAL 102  19.961  10.461  12.441
  751   1HG2  VAL 102          HG21      VAL 102  16.454  10.561  13.734
  752   2HG2  VAL 102          HG22      VAL 102  16.458   9.392  12.414
  753   3HG2  VAL 102          HG23      VAL 102  15.758  10.993  12.172
  Start of MODEL    5
    1   1H    MET   1          HT1       MET   1   4.169  -0.570  -3.508
    2   2H    MET   1          HT2       MET   1   5.258  -1.701  -2.878
    3   3H    MET   1          HT3       MET   1   5.357  -0.071  -2.405
    4    HA   MET   1           HA       MET   1   4.355  -1.376  -0.668
    5   1HB   MET   1          HB2       MET   1   2.369  -0.054  -0.315
    6   2HB   MET   1          HB1       MET   1   3.586   0.966  -1.066
    7   1HG   MET   1          HG2       MET   1   1.269  -0.331  -2.488
    8   2HG   MET   1          HG1       MET   1   1.348   1.353  -1.975
    9   1HE   MET   1          HE1       MET   1   1.623   1.656  -5.861
   10   2HE   MET   1          HE2       MET   1   0.759   2.176  -4.414
   11   3HE   MET   1          HE3       MET   1   0.647   0.501  -4.954
   12    H    THR   2           HN       THR   2   2.046  -2.248  -0.068
   13    HA   THR   2           HA       THR   2   0.704  -3.692  -2.145
   14    HB   THR   2           HB       THR   2   2.736  -5.105  -1.724
   15    HG1  THR   2           HG1      THR   2   1.496  -7.052  -1.502
   16   1HG2  THR   2          HG21      THR   2   2.856  -6.408   0.346
   17   2HG2  THR   2          HG22      THR   2   1.473  -5.523   0.989
   18   3HG2  THR   2          HG23      THR   2   2.991  -4.680   0.676
   19    H    MET   3           HN       MET   3  -0.763  -5.468  -0.798
   20    HA   MET   3           HA       MET   3  -2.353  -3.759   0.907
   21   1HB   MET   3          HB2       MET   3  -2.801  -6.577  -0.086
   22   2HB   MET   3          HB1       MET   3  -3.947  -5.688   0.908
   23   1HG   MET   3          HG2       MET   3  -4.156  -3.993  -0.827
   24   2HG   MET   3          HG1       MET   3  -2.988  -4.861  -1.822
   25   1HE   MET   3          HE1       MET   3  -4.721  -4.808  -3.835
   26   2HE   MET   3          HE2       MET   3  -5.891  -3.963  -2.823
   27   3HE   MET   3          HE3       MET   3  -6.376  -5.403  -3.719
   28    H    GLY   4           HN       GLY   4  -0.547  -6.810   1.245
   29   1HA   GLY   4          HA2       GLY   4   0.617  -6.400   3.615
   30   2HA   GLY   4          HA1       GLY   4  -1.021  -6.783   4.120
   31    H    CYS   5           HN       CYS   5  -0.946  -8.728   4.964
   32    HA   CYS   5           HA       CYS   5  -0.386 -11.017   3.352
   33   1HB   CYS   5          HB2       CYS   5   1.404 -11.958   4.724
   34   2HB   CYS   5          HB1       CYS   5   1.916 -10.414   4.051
   35    H    ARG   6           HN       ARG   6  -0.567 -13.069   4.924
   36    HA   ARG   6           HA       ARG   6  -3.120 -12.920   6.061
   37   1HB   ARG   6          HB2       ARG   6  -2.681 -15.168   6.970
   38   2HB   ARG   6          HB1       ARG   6  -2.226 -15.027   5.279
   39   1HG   ARG   6          HG2       ARG   6   0.124 -14.765   5.956
   40   2HG   ARG   6          HG1       ARG   6  -0.359 -14.976   7.640
   41   1HD   ARG   6          HD2       ARG   6   0.513 -17.051   6.648
   42   2HD   ARG   6          HD1       ARG   6  -1.167 -17.207   7.163
   43    HE   ARG   6           HE       ARG   6  -1.340 -16.504   4.531
   44   1HH1  ARG   6          HH11      ARG   6   0.322 -19.062   6.258
   45   2HH1  ARG   6          HH12      ARG   6   0.169 -20.209   4.956
   46   1HH2  ARG   6          HH21      ARG   6  -1.543 -17.986   2.835
   47   2HH2  ARG   6          HH22      ARG   6  -0.886 -19.589   2.995
   48    H    HIS   7           HN       HIS   7   0.019 -12.394   7.506
   49    HA   HIS   7           HA       HIS   7  -0.662 -12.582  10.221
   50   1HB   HIS   7          HB2       HIS   7   1.373 -10.802   8.865
   51   2HB   HIS   7          HB1       HIS   7   1.251 -11.008  10.607
   52    HD2  HIS   7           HD2      HIS   7   1.289 -14.102  11.051
   53    HE1  HIS   7           HE1      HIS   7   4.561 -14.166   8.366
   54    HE2  HIS   7           HE2      HIS   7   3.463 -15.334  10.332
   55    H    VAL   8           HN       VAL   8  -1.438 -10.185   7.863
   56    HA   VAL   8           HA       VAL   8  -1.695  -7.945   9.571
   57    HB   VAL   8           HB       VAL   8  -1.657  -8.194   6.895
   58   1HG1  VAL   8          HG11      VAL   8  -3.798  -7.549   5.939
   59   2HG1  VAL   8          HG12      VAL   8  -4.555  -7.682   7.526
   60   3HG1  VAL   8          HG13      VAL   8  -3.909  -9.120   6.734
   61   1HG2  VAL   8          HG21      VAL   8  -2.916  -5.931   8.428
   62   2HG2  VAL   8          HG22      VAL   8  -2.289  -5.830   6.782
   63   3HG2  VAL   8          HG23      VAL   8  -1.195  -6.166   8.124
   64    H    ALA   9           HN       ALA   9  -3.770 -10.627   8.872
   65    HA   ALA   9           HA       ALA   9  -6.229  -9.412   9.645
   66   1HB   ALA   9          HB1       ALA   9  -7.132 -11.668   9.594
   67   2HB   ALA   9          HB2       ALA   9  -5.502 -12.334   9.510
   68   3HB   ALA   9          HB3       ALA   9  -6.128 -11.369   8.175
   69    H    GLY  10           HN       GLY  10  -3.610  -9.956  11.499
   70   1HA   GLY  10          HA2       GLY  10  -5.250 -10.588  13.876
   71   2HA   GLY  10          HA1       GLY  10  -3.584 -11.118  13.696
   72    H    ILE  11           HN       ILE  11  -4.113  -8.005  12.459
   73    HA   ILE  11           HA       ILE  11  -2.744  -6.895  14.805
   74    HB   ILE  11           HB       ILE  11  -2.055  -5.041  13.410
   75   1HG1  ILE  11          HG12      ILE  11  -3.530  -6.408  11.153
   76   2HG1  ILE  11          HG11      ILE  11  -4.100  -4.972  11.991
   77   1HG2  ILE  11          HG21      ILE  11  -0.593  -6.236  11.867
   78   2HG2  ILE  11          HG22      ILE  11  -1.583  -7.685  12.044
   79   3HG2  ILE  11          HG23      ILE  11  -0.684  -7.057  13.425
   80   1HD1  ILE  11          HD11      ILE  11  -1.529  -5.146  10.441
   81   2HD1  ILE  11          HD12      ILE  11  -2.230  -3.700  11.171
   82   3HD1  ILE  11          HD13      ILE  11  -3.045  -4.494   9.821
   83    H    ARG  12           HN       ARG  12  -3.387  -4.943  15.731
   84    HA   ARG  12           HA       ARG  12  -6.011  -3.899  14.938
   85   1HB   ARG  12          HB2       ARG  12  -6.444  -3.527  17.437
   86   2HB   ARG  12          HB1       ARG  12  -6.637  -5.159  16.816
   87   1HG   ARG  12          HG2       ARG  12  -3.978  -4.463  17.901
   88   2HG   ARG  12          HG1       ARG  12  -5.307  -4.593  19.057
   89   1HD   ARG  12          HD2       ARG  12  -4.521  -6.706  17.048
   90   2HD   ARG  12          HD1       ARG  12  -4.112  -6.727  18.765
   91    HE   ARG  12           HE       ARG  12  -6.780  -6.509  18.847
   92   1HH1  ARG  12          HH11      ARG  12  -4.720  -8.671  16.996
   93   2HH1  ARG  12          HH12      ARG  12  -5.881  -9.966  16.987
   94   1HH2  ARG  12          HH21      ARG  12  -8.297  -8.207  18.820
   95   2HH2  ARG  12          HH22      ARG  12  -7.902  -9.705  18.034
   96    H    THR  13           HN       THR  13  -6.399  -1.724  16.122
   97    HA   THR  13           HA       THR  13  -4.016  -0.098  15.781
   98    HB   THR  13           HB       THR  13  -6.810   0.785  16.550
   99    HG1  THR  13           HG1      THR  13  -7.131   1.108  14.338
  100   1HG2  THR  13          HG21      THR  13  -4.471   2.300  15.377
  101   2HG2  THR  13          HG22      THR  13  -5.068   2.438  17.030
  102   3HG2  THR  13          HG23      THR  13  -6.075   2.966  15.682
  103    H    VAL  14           HN       VAL  14  -2.665  -0.277  17.454
  104    HA   VAL  14           HA       VAL  14  -3.743  -0.748  20.118
  105    HB   VAL  14           HB       VAL  14  -1.413  -1.341  20.711
  106   1HG1  VAL  14          HG11      VAL  14  -2.986  -3.042  19.906
  107   2HG1  VAL  14          HG12      VAL  14  -1.331  -3.407  19.420
  108   3HG1  VAL  14          HG13      VAL  14  -2.465  -2.735  18.249
  109   1HG2  VAL  14          HG21      VAL  14  -0.875  -0.825  17.787
  110   2HG2  VAL  14          HG22      VAL  14   0.255  -1.555  18.928
  111   3HG2  VAL  14          HG23      VAL  14  -0.253   0.120  19.141
  112    H    THR  15           HN       THR  15  -2.229   0.142  21.911
  113    HA   THR  15           HA       THR  15  -1.982   3.038  21.484
  114    HB   THR  15           HB       THR  15  -2.222   1.572  24.121
  115    HG1  THR  15           HG1      THR  15  -4.156   2.479  22.286
  116   1HG2  THR  15          HG21      THR  15  -2.613   4.478  23.390
  117   2HG2  THR  15          HG22      THR  15  -1.236   3.811  24.268
  118   3HG2  THR  15          HG23      THR  15  -2.844   3.777  24.991
  119    HA   PRO  16           HA       PRO  16   2.437   2.434  21.655
  120   1HB   PRO  16          HB2       PRO  16   2.424   5.306  22.393
  121   2HB   PRO  16          HB1       PRO  16   3.258   4.487  21.068
  122   1HG   PRO  16          HG2       PRO  16   1.119   6.010  20.605
  123   2HG   PRO  16          HG1       PRO  16   1.388   4.509  19.700
  124   1HD   PRO  16          HD2       PRO  16  -0.482   5.046  21.971
  125   2HD   PRO  16          HD1       PRO  16  -0.732   4.066  20.511
  126    H    SER  17           HN       SER  17   3.726   1.801  23.263
  127    HA   SER  17           HA       SER  17   2.988   2.092  25.991
  128   1HB   SER  17          HB2       SER  17   5.617   1.148  24.822
  129   2HB   SER  17          HB1       SER  17   5.044   0.862  26.466
  130    HG   SER  17           HG       SER  17   3.237  -0.260  25.491
  131    H    ALA  18           HN       ALA  18   5.162   3.827  23.877
  132    HA   ALA  18           HA       ALA  18   5.723   5.722  26.020
  133   1HB   ALA  18          HB1       ALA  18   8.119   5.706  25.600
  134   2HB   ALA  18          HB2       ALA  18   7.917   4.441  24.388
  135   3HB   ALA  18          HB3       ALA  18   7.573   4.100  26.084
  136    H    LEU  19           HN       LEU  19   6.979   7.644  25.090
  137    HA   LEU  19           HA       LEU  19   5.652   8.515  22.676
  138   1HB   LEU  19          HB2       LEU  19   7.571   9.817  24.589
  139   2HB   LEU  19          HB1       LEU  19   7.156  10.581  23.069
  140    HG   LEU  19           HG       LEU  19   4.756  10.549  23.776
  141   1HD1  LEU  19          HD11      LEU  19   5.896   9.734  26.443
  142   2HD1  LEU  19          HD12      LEU  19   4.874   8.736  25.407
  143   3HD1  LEU  19          HD13      LEU  19   4.228  10.212  26.126
  144   1HD2  LEU  19          HD21      LEU  19   4.971  12.422  25.315
  145   2HD2  LEU  19          HD22      LEU  19   6.150  12.540  24.007
  146   3HD2  LEU  19          HD23      LEU  19   6.658  11.999  25.607
  147    H    GLY  20           HN       GLY  20   8.956   7.817  23.690
  148   1HA   GLY  20          HA2       GLY  20   9.725   7.723  20.843
  149   2HA   GLY  20          HA1       GLY  20  10.831   8.168  22.138
  150    H    CYS  21           HN       CYS  21  12.330   6.556  21.799
  151    HA   CYS  21           HA       CYS  21  11.557   3.814  21.542
  152   1HB   CYS  21          HB2       CYS  21  14.212   5.173  21.944
  153   2HB   CYS  21          HB1       CYS  21  14.054   3.419  21.932
  154    HG   CYS  21           HG       CYS  21  13.435   5.569  19.354
  155    H    GLU  22           HN       GLU  22  10.629   2.835  23.169
  156    HA   GLU  22           HA       GLU  22  10.705   3.306  25.855
  157   1HB   GLU  22          HB2       GLU  22   9.149   1.757  24.917
  158   2HB   GLU  22          HB1       GLU  22  10.437   0.727  24.315
  159   1HG   GLU  22          HG2       GLU  22  11.001   0.051  26.554
  160   2HG   GLU  22          HG1       GLU  22   9.818   1.177  27.223
  161    H    GLU  23           HN       GLU  23  13.108   1.681  23.924
  162    HA   GLU  23           HA       GLU  23  14.559   0.598  26.148
  163   1HB   GLU  23          HB2       GLU  23  14.499  -0.357  23.803
  164   2HB   GLU  23          HB1       GLU  23  15.539   0.975  23.318
  165   1HG   GLU  23          HG2       GLU  23  16.826  -1.034  23.711
  166   2HG   GLU  23          HG1       GLU  23  17.250   0.220  24.875
  167    H    CYS  24           HN       CYS  24  15.482   3.023  23.687
  168    HA   CYS  24           HA       CYS  24  17.776   3.942  24.929
  169   1HB   CYS  24          HB2       CYS  24  15.900   5.458  23.109
  170   2HB   CYS  24          HB1       CYS  24  17.552   5.934  23.488
  171    HG   CYS  24           HG       CYS  24  18.198   4.905  21.196
  172    H    LEU  25           HN       LEU  25  14.448   4.820  25.588
  173    HA   LEU  25           HA       LEU  25  14.930   7.306  26.834
  174   1HB   LEU  25          HB2       LEU  25  12.673   5.336  27.102
  175   2HB   LEU  25          HB1       LEU  25  12.693   6.873  27.946
  176    HG   LEU  25           HG       LEU  25  12.763   6.544  24.945
  177   1HD1  LEU  25          HD11      LEU  25  10.618   5.869  25.881
  178   2HD1  LEU  25          HD12      LEU  25  10.476   7.395  25.009
  179   3HD1  LEU  25          HD13      LEU  25  10.518   7.388  26.772
  180   1HD2  LEU  25          HD21      LEU  25  12.385   8.955  24.905
  181   2HD2  LEU  25          HD22      LEU  25  13.900   8.561  25.717
  182   3HD2  LEU  25          HD23      LEU  25  12.481   9.005  26.666
  183    H    LYS  26           HN       LYS  26  15.589   4.136  27.912
  184    HA   LYS  26           HA       LYS  26  15.258   4.530  30.702
  185   1HB   LYS  26          HB2       LYS  26  16.275   2.445  30.978
  186   2HB   LYS  26          HB1       LYS  26  15.542   2.323  29.386
  187   1HG   LYS  26          HG2       LYS  26  17.875   3.098  28.542
  188   2HG   LYS  26          HG1       LYS  26  18.422   2.565  30.131
  189   1HD   LYS  26          HD2       LYS  26  17.045   0.921  28.017
  190   2HD   LYS  26          HD1       LYS  26  18.705   0.757  28.588
  191   1HE   LYS  26          HE2       LYS  26  17.917   0.057  30.767
  192   2HE   LYS  26          HE1       LYS  26  16.245   0.314  30.272
  193   1HZ   LYS  26          HZ1       LYS  26  18.133  -1.764  29.344
  194   2HZ   LYS  26          HZ2       LYS  26  16.753  -1.360  28.447
  195   3HZ   LYS  26          HZ3       LYS  26  16.591  -1.962  30.027
  196    H    ILE  27           HN       ILE  27  17.694   5.461  28.443
  197    HA   ILE  27           HA       ILE  27  19.369   6.449  30.654
  198    HB   ILE  27           HB       ILE  27  21.347   6.094  29.120
  199   1HG1  ILE  27          HG12      ILE  27  19.302   4.435  27.626
  200   2HG1  ILE  27          HG11      ILE  27  20.209   5.807  27.006
  201   1HG2  ILE  27          HG21      ILE  27  19.869   3.635  30.048
  202   2HG2  ILE  27          HG22      ILE  27  20.890   4.666  31.051
  203   3HG2  ILE  27          HG23      ILE  27  21.599   3.746  29.724
  204   1HD1  ILE  27          HD11      ILE  27  22.270   4.531  27.163
  205   2HD1  ILE  27          HD12      ILE  27  21.078   3.693  26.170
  206   3HD1  ILE  27          HD13      ILE  27  21.380   3.159  27.823
  207    H    GLY  28           HN       GLY  28  17.369   7.400  28.332
  208   1HA   GLY  28          HA2       GLY  28  16.966   9.446  27.370
  209   2HA   GLY  28          HA1       GLY  28  18.304  10.078  28.315
  210    H    SER  29           HN       SER  29  18.709   7.420  26.098
  211    HA   SER  29           HA       SER  29  20.647   9.001  24.625
  212   1HB   SER  29          HB2       SER  29  19.978   6.053  24.594
  213   2HB   SER  29          HB1       SER  29  21.223   6.790  23.587
  214    HG   SER  29           HG       SER  29  21.741   7.668  25.965
  215    HA   PRO  30           HA       PRO  30  18.238   9.731  21.026
  216   1HB   PRO  30          HB2       PRO  30  20.536   9.070  19.322
  217   2HB   PRO  30          HB1       PRO  30  19.735  10.623  19.570
  218   1HG   PRO  30          HG2       PRO  30  22.194  10.132  20.529
  219   2HG   PRO  30          HG1       PRO  30  21.034  11.150  21.403
  220   1HD   PRO  30          HD2       PRO  30  21.765   8.280  21.873
  221   2HD   PRO  30          HD1       PRO  30  21.525   9.588  23.054
  222    H    TRP  31           HN       TRP  31  17.731   8.860  18.800
  223    HA   TRP  31           HA       TRP  31  18.181   6.029  18.419
  224   1HB   TRP  31          HB2       TRP  31  15.728   5.584  18.141
  225   2HB   TRP  31          HB1       TRP  31  16.234   5.885  19.797
  226    HD1  TRP  31           HD1      TRP  31  14.467   7.754  16.885
  227    HE1  TRP  31           HE1      TRP  31  12.856   9.472  17.920
  228    HE3  TRP  31           HE3      TRP  31  15.641   7.109  21.823
  229    HZ2  TRP  31           HZ2      TRP  31  12.165  10.422  20.485
  230    HZ3  TRP  31           HZ3      TRP  31  14.456   8.460  23.501
  231    HH2  TRP  31           HH2      TRP  31  12.754  10.083  22.843
  232    H    VAL  32           HN       VAL  32  17.375   5.296  16.309
  233    HA   VAL  32           HA       VAL  32  17.650   7.455  14.359
  234    HB   VAL  32           HB       VAL  32  17.671   4.465  13.903
  235   1HG1  VAL  32          HG11      VAL  32  18.668   5.062  11.726
  236   2HG1  VAL  32          HG12      VAL  32  18.397   6.766  12.092
  237   3HG1  VAL  32          HG13      VAL  32  17.025   5.674  11.910
  238   1HG2  VAL  32          HG21      VAL  32  19.550   5.142  15.285
  239   2HG2  VAL  32          HG22      VAL  32  19.959   6.418  14.139
  240   3HG2  VAL  32          HG23      VAL  32  20.104   4.726  13.664
  241    H    HIS  33           HN       HIS  33  15.583   4.577  14.822
  242    HA   HIS  33           HA       HIS  33  13.362   6.094  13.663
  243   1HB   HIS  33          HB2       HIS  33  14.306   3.373  12.784
  244   2HB   HIS  33          HB1       HIS  33  12.651   3.909  12.521
  245    HD1  HIS  33           HD1      HIS  33  15.590   3.586  10.700
  246    HD2  HIS  33           HD2      HIS  33  12.888   6.717  11.197
  247    HE1  HIS  33           HE1      HIS  33  15.908   5.093   8.704
  248    HE2  HIS  33           HE2      HIS  33  14.100   6.843   8.919
  249    H    LEU  34           HN       LEU  34  11.299   5.373  14.211
  250    HA   LEU  34           HA       LEU  34  11.195   3.788  16.704
  251   1HB   LEU  34          HB2       LEU  34   9.328   5.947  15.706
  252   2HB   LEU  34          HB1       LEU  34   9.128   5.043  17.194
  253    HG   LEU  34           HG       LEU  34  11.475   6.854  16.639
  254   1HD1  LEU  34          HD11      LEU  34   9.432   8.162  16.693
  255   2HD1  LEU  34          HD12      LEU  34  10.367   8.423  18.165
  256   3HD1  LEU  34          HD13      LEU  34   8.948   7.377  18.196
  257   1HD2  LEU  34          HD21      LEU  34  10.452   5.576  19.167
  258   2HD2  LEU  34          HD22      LEU  34  11.827   6.675  19.042
  259   3HD2  LEU  34          HD23      LEU  34  11.891   5.090  18.271
  260    H    ARG  35           HN       ARG  35   9.971   1.967  16.671
  261    HA   ARG  35           HA       ARG  35   7.848   1.781  14.691
  262   1HB   ARG  35          HB2       ARG  35   8.583  -0.618  14.206
  263   2HB   ARG  35          HB1       ARG  35   9.471   0.690  13.442
  264   1HG   ARG  35          HG2       ARG  35  11.332  -0.208  14.216
  265   2HG   ARG  35          HG1       ARG  35  10.798   0.196  15.848
  266   1HD   ARG  35          HD2       ARG  35   9.955  -2.319  14.442
  267   2HD   ARG  35          HD1       ARG  35  11.420  -2.218  15.407
  268    HE   ARG  35           HE       ARG  35   9.234  -1.278  16.912
  269   1HH1  ARG  35          HH11      ARG  35  10.551  -4.251  15.604
  270   2HH1  ARG  35          HH12      ARG  35   9.885  -5.247  16.861
  271   1HH2  ARG  35          HH21      ARG  35   8.353  -2.577  18.569
  272   2HH2  ARG  35          HH22      ARG  35   8.625  -4.288  18.551
  273    H    ILE  36           HN       ILE  36   6.089   0.779  15.331
  274    HA   ILE  36           HA       ILE  36   6.105  -0.438  18.025
  275    HB   ILE  36           HB       ILE  36   5.036   1.728  18.107
  276   1HG1  ILE  36          HG12      ILE  36   2.966  -0.477  18.077
  277   2HG1  ILE  36          HG11      ILE  36   3.980  -0.022  19.443
  278   1HG2  ILE  36          HG21      ILE  36   3.125   2.320  16.713
  279   2HG2  ILE  36          HG22      ILE  36   3.268   0.786  15.856
  280   3HG2  ILE  36          HG23      ILE  36   4.553   1.988  15.733
  281   1HD1  ILE  36          HD11      ILE  36   1.730   0.851  19.686
  282   2HD1  ILE  36          HD12      ILE  36   1.881   1.703  18.150
  283   3HD1  ILE  36          HD13      ILE  36   2.895   2.164  19.518
  284    H    CYS  37           HN       CYS  37   4.949  -2.361  18.279
  285    HA   CYS  37           HA       CYS  37   4.208  -3.810  15.913
  286   1HB   CYS  37          HB2       CYS  37   3.314  -4.486  18.709
  287   2HB   CYS  37          HB1       CYS  37   3.456  -5.569  17.337
  288    H    ARG  38           HN       ARG  38   2.169  -4.164  15.086
  289    HA   ARG  38           HA       ARG  38  -0.021  -2.555  16.081
  290   1HB   ARG  38          HB2       ARG  38   0.147  -4.601  13.860
  291   2HB   ARG  38          HB1       ARG  38  -1.288  -3.655  14.226
  292   1HG   ARG  38          HG2       ARG  38   1.371  -2.499  13.415
  293   2HG   ARG  38          HG1       ARG  38   0.001  -2.762  12.332
  294   1HD   ARG  38          HD2       ARG  38   0.065  -0.961  14.751
  295   2HD   ARG  38          HD1       ARG  38   0.060  -0.451  13.062
  296    HE   ARG  38           HE       ARG  38  -2.189  -2.027  14.096
  297   1HH1  ARG  38          HH11      ARG  38  -0.935   1.012  12.885
  298   2HH1  ARG  38          HH12      ARG  38  -2.521   1.674  12.592
  299   1HH2  ARG  38          HH21      ARG  38  -4.260  -1.136  13.702
  300   2HH2  ARG  38          HH22      ARG  38  -4.390   0.467  13.059
  301    H    THR  39           HN       THR  39   0.932  -4.361  18.004
  302    HA   THR  39           HA       THR  39  -1.300  -6.228  18.304
  303    HB   THR  39           HB       THR  39   1.468  -7.206  18.919
  304    HG1  THR  39           HG1      THR  39   0.257  -7.819  16.446
  305   1HG2  THR  39          HG21      THR  39  -1.098  -8.588  18.125
  306   2HG2  THR  39          HG22      THR  39  -0.447  -8.471  19.760
  307   3HG2  THR  39          HG23      THR  39   0.419  -9.391  18.529
  308    H    CYS  40           HN       CYS  40   1.782  -5.361  19.930
  309    HA   CYS  40           HA       CYS  40   0.359  -5.532  22.487
  310   1HB   CYS  40          HB2       CYS  40   2.449  -5.973  23.537
  311   2HB   CYS  40          HB1       CYS  40   2.429  -6.935  22.063
  312    H    GLY  41           HN       GLY  41   1.648  -3.216  20.354
  313   1HA   GLY  41          HA2       GLY  41   1.433  -0.916  20.539
  314   2HA   GLY  41          HA1       GLY  41   0.983  -1.123  22.221
  315    H    HIS  42           HN       HIS  42   3.814  -2.797  21.862
  316    HA   HIS  42           HA       HIS  42   5.232  -0.757  23.297
  317   1HB   HIS  42          HB2       HIS  42   5.857  -3.573  22.524
  318   2HB   HIS  42          HB1       HIS  42   7.180  -2.510  22.988
  319    HD1  HIS  42           HD1      HIS  42   7.610  -2.248  25.442
  320    HD2  HIS  42           HD2      HIS  42   3.845  -3.853  24.644
  321    HE1  HIS  42           HE1      HIS  42   6.678  -2.960  27.667
  322    HE2  HIS  42           HE2      HIS  42   4.441  -4.001  27.158
  323    H    VAL  43           HN       VAL  43   6.299   0.829  22.453
  324    HA   VAL  43           HA       VAL  43   7.140   0.789  19.674
  325    HB   VAL  43           HB       VAL  43   7.460   2.990  21.726
  326   1HG1  VAL  43          HG11      VAL  43   7.657   3.027  18.717
  327   2HG1  VAL  43          HG12      VAL  43   8.989   3.212  19.856
  328   3HG1  VAL  43          HG13      VAL  43   7.732   4.444  19.764
  329   1HG2  VAL  43          HG21      VAL  43   5.296   2.606  19.660
  330   2HG2  VAL  43          HG22      VAL  43   5.496   4.021  20.693
  331   3HG2  VAL  43          HG23      VAL  43   5.104   2.457  21.408
  332    H    GLY  44           HN       GLY  44   9.134   0.239  19.066
  333   1HA   GLY  44          HA2       GLY  44  11.253   0.294  21.122
  334   2HA   GLY  44          HA1       GLY  44  11.053  -1.072  20.034
  335    H    CYS  45           HN       CYS  45  13.431   0.391  20.288
  336    HA   CYS  45           HA       CYS  45  13.690   2.261  18.154
  337   1HB   CYS  45          HB2       CYS  45  16.119   2.025  18.552
  338   2HB   CYS  45          HB1       CYS  45  15.242   2.300  20.054
  339    HG   CYS  45           HG       CYS  45  16.242  -0.788  18.989
  340    H    CYS  46           HN       CYS  46  13.977   1.868  16.067
  341    HA   CYS  46           HA       CYS  46  13.704  -0.653  14.917
  342   1HB   CYS  46          HB2       CYS  46  13.305   1.520  13.771
  343   2HB   CYS  46          HB1       CYS  46  15.043   1.783  13.718
  344    HG   CYS  46           HG       CYS  46  15.178   0.844  11.345
  345    H    ASP  47           HN       ASP  47  15.312  -1.796  13.553
  346    HA   ASP  47           HA       ASP  47  17.542  -2.538  15.126
  347   1HB   ASP  47          HB2       ASP  47  18.141  -3.994  13.211
  348   2HB   ASP  47          HB1       ASP  47  16.459  -4.164  13.698
  349    H    ASP  48           HN       ASP  48  17.147   0.091  13.130
  350    HA   ASP  48           HA       ASP  48  19.725   0.433  12.047
  351   1HB   ASP  48          HB2       ASP  48  17.828   2.571  13.054
  352   2HB   ASP  48          HB1       ASP  48  19.193   2.828  11.977
  353    H    SER  49           HN       SER  49  18.353   1.010  15.218
  354    HA   SER  49           HA       SER  49  20.722   2.396  16.170
  355   1HB   SER  49          HB2       SER  49  18.204   1.576  17.646
  356   2HB   SER  49          HB1       SER  49  19.453   2.668  18.248
  357    HG   SER  49           HG       SER  49  18.780   3.637  15.935
  358    HA   PRO  50           HA       PRO  50  23.024  -1.025  17.518
  359   1HB   PRO  50          HB2       PRO  50  23.980  -0.127  19.950
  360   2HB   PRO  50          HB1       PRO  50  24.654   0.301  18.374
  361   1HG   PRO  50          HG2       PRO  50  22.750   1.829  20.100
  362   2HG   PRO  50          HG1       PRO  50  24.128   2.420  19.153
  363   1HD   PRO  50          HD2       PRO  50  21.619   2.721  18.281
  364   2HD   PRO  50          HD1       PRO  50  22.943   2.350  17.156
  365    H    HIS  51           HN       HIS  51  20.669   0.205  19.818
  366    HA   HIS  51           HA       HIS  51  20.800  -1.892  21.694
  367   1HB   HIS  51          HB2       HIS  51  18.426  -0.176  20.926
  368   2HB   HIS  51          HB1       HIS  51  18.486  -1.232  22.329
  369    HD1  HIS  51           HD1      HIS  51  19.266  -0.171  24.453
  370    HD2  HIS  51           HD2      HIS  51  20.430   1.984  21.089
  371    HE1  HIS  51           HE1      HIS  51  20.185   1.996  25.318
  372    HE2  HIS  51           HE2      HIS  51  21.142   3.148  23.286
  373    H    LYS  52           HN       LYS  52  18.962  -1.467  18.728
  374    HA   LYS  52           HA       LYS  52  17.552  -2.781  17.543
  375   1HB   LYS  52          HB2       LYS  52  19.576  -4.824  18.442
  376   2HB   LYS  52          HB1       LYS  52  18.335  -5.150  17.241
  377   1HG   LYS  52          HG2       LYS  52  19.274  -3.149  15.973
  378   2HG   LYS  52          HG1       LYS  52  20.660  -3.270  17.058
  379   1HD   LYS  52          HD2       LYS  52  21.046  -5.561  16.337
  380   2HD   LYS  52          HD1       LYS  52  19.622  -5.489  15.297
  381   1HE   LYS  52          HE2       LYS  52  20.702  -3.615  14.063
  382   2HE   LYS  52          HE1       LYS  52  22.152  -3.872  15.032
  383   1HZ   LYS  52          HZ1       LYS  52  22.244  -6.152  14.163
  384   2HZ   LYS  52          HZ2       LYS  52  22.364  -4.990  12.933
  385   3HZ   LYS  52          HZ3       LYS  52  20.908  -5.823  13.172
  386    H    HIS  53           HN       HIS  53  16.680  -2.334  20.219
  387    HA   HIS  53           HA       HIS  53  15.698  -4.635  21.472
  388   1HB   HIS  53          HB2       HIS  53  15.705  -2.331  22.465
  389   2HB   HIS  53          HB1       HIS  53  14.356  -1.920  21.414
  390    HD1  HIS  53           HD1      HIS  53  12.562  -1.608  23.168
  391    HD2  HIS  53           HD2      HIS  53  14.546  -5.235  23.550
  392    HE1  HIS  53           HE1      HIS  53  11.287  -2.887  24.910
  393    HE2  HIS  53           HE2      HIS  53  12.640  -4.980  25.283
  394    H    ALA  54           HN       ALA  54  14.786  -3.140  18.544
  395    HA   ALA  54           HA       ALA  54  12.088  -3.945  18.361
  396   1HB   ALA  54          HB1       ALA  54  12.463  -3.667  15.908
  397   2HB   ALA  54          HB2       ALA  54  14.162  -3.354  16.263
  398   3HB   ALA  54          HB3       ALA  54  12.916  -2.270  16.886
  399    H    THR  55           HN       THR  55  15.097  -5.465  17.214
  400    HA   THR  55           HA       THR  55  13.693  -7.696  16.074
  401    HB   THR  55           HB       THR  55  16.052  -8.597  15.760
  402    HG1  THR  55           HG1      THR  55  17.697  -7.445  16.490
  403   1HG2  THR  55          HG21      THR  55  15.403  -5.868  14.639
  404   2HG2  THR  55          HG22      THR  55  14.868  -7.415  13.980
  405   3HG2  THR  55          HG23      THR  55  16.582  -6.997  13.972
  406    H    ARG  56           HN       ARG  56  15.659  -7.090  18.929
  407    HA   ARG  56           HA       ARG  56  15.745  -9.701  19.950
  408   1HB   ARG  56          HB2       ARG  56  15.666  -7.099  21.495
  409   2HB   ARG  56          HB1       ARG  56  16.270  -8.642  22.088
  410   1HG   ARG  56          HG2       ARG  56  18.140  -8.581  20.677
  411   2HG   ARG  56          HG1       ARG  56  17.444  -7.311  19.671
  412   1HD   ARG  56          HD2       ARG  56  19.107  -6.279  20.990
  413   2HD   ARG  56          HD1       ARG  56  17.558  -5.810  21.685
  414    HE   ARG  56           HE       ARG  56  18.199  -7.940  23.177
  415   1HH1  ARG  56          HH11      ARG  56  19.988  -5.086  22.242
  416   2HH1  ARG  56          HH12      ARG  56  21.025  -5.111  23.640
  417   1HH2  ARG  56          HH21      ARG  56  19.551  -7.992  25.012
  418   2HH2  ARG  56          HH22      ARG  56  20.774  -6.776  25.223
  419    H    HIS  57           HN       HIS  57  13.350  -7.144  20.240
  420    HA   HIS  57           HA       HIS  57  11.649  -8.516  22.059
  421   1HB   HIS  57          HB2       HIS  57  11.513  -6.126  21.894
  422   2HB   HIS  57          HB1       HIS  57  11.193  -6.207  20.169
  423    HD1  HIS  57           HD1      HIS  57   9.487  -7.016  23.483
  424    HD2  HIS  57           HD2      HIS  57   8.605  -6.303  19.477
  425    HE1  HIS  57           HE1      HIS  57   6.966  -6.803  23.325
  426    H    PHE  58           HN       PHE  58  11.781  -8.269  18.525
  427    HA   PHE  58           HA       PHE  58   9.418  -9.714  17.983
  428   1HB   PHE  58          HB2       PHE  58  10.388  -8.460  16.203
  429   2HB   PHE  58          HB1       PHE  58  11.936  -9.278  16.376
  430    HD1  PHE  58           HD1      PHE  58   8.414 -10.485  16.006
  431    HD2  PHE  58           HD2      PHE  58  12.394 -10.528  14.524
  432    HE1  PHE  58           HE1      PHE  58   7.755 -12.121  14.293
  433    HE2  PHE  58           HE2      PHE  58  11.748 -12.164  12.808
  434    HZ   PHE  58           HZ       PHE  58   9.423 -12.965  12.691
  435    H    HIS  59           HN       HIS  59  12.752 -10.704  18.504
  436    HA   HIS  59           HA       HIS  59  12.507 -13.429  17.901
  437   1HB   HIS  59          HB2       HIS  59  14.641 -12.156  18.264
  438   2HB   HIS  59          HB1       HIS  59  14.306 -12.173  19.989
  439    HD1  HIS  59           HD1      HIS  59  14.639 -14.430  21.246
  440    HD2  HIS  59           HD2      HIS  59  15.595 -14.548  17.194
  441    HE1  HIS  59           HE1      HIS  59  15.945 -16.553  20.913
  442    HE2  HIS  59           HE2      HIS  59  16.497 -16.621  18.458
  443    H    ALA  60           HN       ALA  60  11.627 -11.601  20.742
  444    HA   ALA  60           HA       ALA  60  11.297 -14.005  22.348
  445   1HB   ALA  60          HB1       ALA  60  12.381 -12.044  23.324
  446   2HB   ALA  60          HB2       ALA  60  10.918 -12.493  24.201
  447   3HB   ALA  60          HB3       ALA  60  10.898 -11.117  23.097
  448    H    THR  61           HN       THR  61   9.260 -11.334  21.138
  449    HA   THR  61           HA       THR  61   6.931 -12.642  22.333
  450    HB   THR  61           HB       THR  61   5.723 -10.535  21.738
  451    HG1  THR  61           HG1      THR  61   8.350  -9.725  20.961
  452   1HG2  THR  61          HG21      THR  61   6.691 -10.870  23.964
  453   2HG2  THR  61          HG22      THR  61   6.780  -9.177  23.476
  454   3HG2  THR  61          HG23      THR  61   8.220 -10.194  23.402
  455    H    GLY  62           HN       GLY  62   8.442 -12.387  19.309
  456   1HA   GLY  62          HA2       GLY  62   7.824 -13.125  17.225
  457   2HA   GLY  62          HA1       GLY  62   6.485 -13.948  18.010
  458    H    HIS  63           HN       HIS  63   7.260 -10.488  17.699
  459    HA   HIS  63           HA       HIS  63   4.622 -10.128  16.436
  460   1HB   HIS  63          HB2       HIS  63   6.255  -8.172  18.074
  461   2HB   HIS  63          HB1       HIS  63   4.784  -7.746  17.206
  462    HD2  HIS  63           HD2      HIS  63   3.363 -10.709  18.245
  463    HE1  HIS  63           HE1      HIS  63   3.512  -8.640  21.928
  464    HE2  HIS  63           HE2      HIS  63   2.352 -10.480  20.620
  465    HA   PRO  64           HA       PRO  64   7.649  -9.423  13.154
  466   1HB   PRO  64          HB2       PRO  64   6.169 -10.345  11.122
  467   2HB   PRO  64          HB1       PRO  64   6.902 -11.435  12.306
  468   1HG   PRO  64          HG2       PRO  64   4.081 -10.449  12.132
  469   2HG   PRO  64          HG1       PRO  64   4.674 -12.081  12.488
  470   1HD   PRO  64          HD2       PRO  64   3.854 -10.291  14.399
  471   2HD   PRO  64          HD1       PRO  64   5.011 -11.602  14.698
  472    H    ILE  65           HN       ILE  65   4.408  -8.119  13.372
  473    HA   ILE  65           HA       ILE  65   4.939  -6.351  11.104
  474    HB   ILE  65           HB       ILE  65   2.370  -6.862  12.600
  475   1HG1  ILE  65          HG12      ILE  65   3.246  -7.494   9.772
  476   2HG1  ILE  65          HG11      ILE  65   3.098  -8.660  11.082
  477   1HG2  ILE  65          HG21      ILE  65   2.905  -5.007  10.275
  478   2HG2  ILE  65          HG22      ILE  65   2.445  -4.532  11.910
  479   3HG2  ILE  65          HG23      ILE  65   1.308  -5.424  10.899
  480   1HD1  ILE  65          HD11      ILE  65   0.856  -7.078   9.849
  481   2HD1  ILE  65          HD12      ILE  65   0.692  -8.230  11.175
  482   3HD1  ILE  65          HD13      ILE  65   1.204  -8.786   9.581
  483    H    ILE  66           HN       ILE  66   5.626  -4.426  11.366
  484    HA   ILE  66           HA       ILE  66   5.111  -2.998  13.887
  485    HB   ILE  66           HB       ILE  66   7.344  -1.952  13.659
  486   1HG1  ILE  66          HG12      ILE  66   7.785  -4.036  11.504
  487   2HG1  ILE  66          HG11      ILE  66   7.578  -2.313  11.210
  488   1HG2  ILE  66          HG21      ILE  66   7.360  -4.963  13.812
  489   2HG2  ILE  66          HG22      ILE  66   7.039  -3.850  15.142
  490   3HG2  ILE  66          HG23      ILE  66   8.638  -3.900  14.401
  491   1HD1  ILE  66          HD11      ILE  66   9.828  -3.592  12.746
  492   2HD1  ILE  66          HD12      ILE  66   9.623  -1.863  12.468
  493   3HD1  ILE  66          HD13      ILE  66   9.913  -2.946  11.107
  494    H    GLU  67           HN       GLU  67   4.678  -0.831  13.702
  495    HA   GLU  67           HA       GLU  67   4.338   0.187  10.964
  496   1HB   GLU  67          HB2       GLU  67   2.277   0.038  12.328
  497   2HB   GLU  67          HB1       GLU  67   3.009   1.088  13.531
  498   1HG   GLU  67          HG2       GLU  67   3.100   2.902  11.913
  499   2HG   GLU  67          HG1       GLU  67   2.404   1.848  10.682
  500    H    GLY  68           HN       GLY  68   5.165   2.200  10.423
  501   1HA   GLY  68          HA2       GLY  68   7.490   3.062  11.815
  502   2HA   GLY  68          HA1       GLY  68   6.724   3.891  10.467
  503    H    TYR  69           HN       TYR  69   7.448   4.061  13.708
  504    HA   TYR  69           HA       TYR  69   5.072   5.575  14.443
  505   1HB   TYR  69          HB2       TYR  69   6.053   3.802  15.938
  506   2HB   TYR  69          HB1       TYR  69   7.435   4.863  16.185
  507    HD1  TYR  69           HD1      TYR  69   7.417   6.067  18.145
  508    HD2  TYR  69           HD2      TYR  69   3.706   5.125  16.293
  509    HE1  TYR  69           HE1      TYR  69   6.224   7.180  19.982
  510    HE2  TYR  69           HE2      TYR  69   2.503   6.235  18.126
  511    HH   TYR  69           HH       TYR  69   4.204   8.053  20.599
  512    H    ASP  70           HN       ASP  70   8.452   6.098  13.683
  513    HA   ASP  70           HA       ASP  70   8.303   8.830  14.618
  514   1HB   ASP  70          HB2       ASP  70  10.602   9.117  13.961
  515   2HB   ASP  70          HB1       ASP  70  10.440   7.611  14.846
  516    HA   PRO  71           HA       PRO  71   7.455   9.782  10.145
  517   1HB   PRO  71          HB2       PRO  71   7.694   7.914   8.196
  518   2HB   PRO  71          HB1       PRO  71   9.084   8.801   8.829
  519   1HG   PRO  71          HG2       PRO  71   8.441   5.985   9.118
  520   2HG   PRO  71          HG1       PRO  71   9.923   6.835   9.579
  521   1HD   PRO  71          HD2       PRO  71   7.593   6.097  11.235
  522   2HD   PRO  71          HD1       PRO  71   9.254   6.487  11.733
  523    HA   PRO  72           HA       PRO  72   3.515   7.501  10.930
  524   1HB   PRO  72          HB2       PRO  72   2.225  10.065  11.278
  525   2HB   PRO  72          HB1       PRO  72   2.509   8.802  12.476
  526   1HG   PRO  72          HG2       PRO  72   3.756  11.238  12.507
  527   2HG   PRO  72          HG1       PRO  72   4.441   9.767  13.220
  528   1HD   PRO  72          HD2       PRO  72   5.049  11.064  10.591
  529   2HD   PRO  72          HD1       PRO  72   6.154  10.299  11.754
  530    H    GLU  73           HN       GLU  73   3.809   7.124   8.564
  531    HA   GLU  73           HA       GLU  73   1.956   8.799   7.004
  532   1HB   GLU  73          HB2       GLU  73   4.081   6.886   6.015
  533   2HB   GLU  73          HB1       GLU  73   3.035   7.871   5.001
  534   1HG   GLU  73          HG2       GLU  73   4.025   9.884   6.161
  535   2HG   GLU  73          HG1       GLU  73   5.220   8.783   6.844
  536    H    GLY  74           HN       GLY  74   1.998   6.077   8.773
  537   1HA   GLY  74          HA2       GLY  74   0.469   4.371   8.974
  538   2HA   GLY  74          HA1       GLY  74  -0.402   5.060   7.612
  539    H    TRP  75           HN       TRP  75   2.502   3.196   8.406
  540    HA   TRP  75           HA       TRP  75   1.948   1.485   6.119
  541   1HB   TRP  75          HB2       TRP  75   4.362   1.522   5.454
  542   2HB   TRP  75          HB1       TRP  75   3.511   3.033   5.159
  543    HD1  TRP  75           HD1      TRP  75   4.122   5.113   6.801
  544    HE1  TRP  75           HE1      TRP  75   6.281   5.643   8.098
  545    HE3  TRP  75           HE3      TRP  75   6.280   0.478   6.701
  546    HZ2  TRP  75           HZ2      TRP  75   8.598   4.274   8.954
  547    HZ3  TRP  75           HZ3      TRP  75   8.470   0.173   7.781
  548    HH2  TRP  75           HH2      TRP  75   9.604   2.033   8.884
  549    H    GLY  76           HN       GLY  76   2.618  -0.610   6.365
  550   1HA   GLY  76          HA2       GLY  76   3.626  -1.252   9.067
  551   2HA   GLY  76          HA1       GLY  76   2.415  -2.212   8.229
  552    H    TRP  77           HN       TRP  77   5.404  -2.380   9.212
  553    HA   TRP  77           HA       TRP  77   6.431  -3.733   6.807
  554   1HB   TRP  77          HB2       TRP  77   7.930  -2.010   7.676
  555   2HB   TRP  77          HB1       TRP  77   7.875  -2.733   9.279
  556    HD1  TRP  77           HD1      TRP  77   9.481  -4.759   9.761
  557    HE1  TRP  77           HE1      TRP  77  11.398  -5.854   8.436
  558    HE3  TRP  77           HE3      TRP  77   8.658  -2.595   5.200
  559    HZ2  TRP  77           HZ2      TRP  77  12.426  -5.802   5.811
  560    HZ3  TRP  77           HZ3      TRP  77  10.156  -3.172   3.337
  561    HH2  TRP  77           HH2      TRP  77  12.001  -4.742   3.637
  562    H    CYS  78           HN       CYS  78   6.844  -5.899   6.875
  563    HA   CYS  78           HA       CYS  78   6.243  -7.254   9.427
  564   1HB   CYS  78          HB2       CYS  78   4.647  -7.495   7.370
  565   2HB   CYS  78          HB1       CYS  78   5.888  -8.570   6.754
  566    H    TYR  79           HN       TYR  79   8.040  -8.039  10.287
  567    HA   TYR  79           HA       TYR  79  10.539  -7.923   9.200
  568   1HB   TYR  79          HB2       TYR  79   9.438  -9.614  11.414
  569   2HB   TYR  79          HB1       TYR  79  11.127  -9.759  10.939
  570    HD1  TYR  79           HD1      TYR  79  12.321  -7.361  10.665
  571    HD2  TYR  79           HD2      TYR  79   8.990  -8.188  13.183
  572    HE1  TYR  79           HE1      TYR  79  12.906  -5.426  12.062
  573    HE2  TYR  79           HE2      TYR  79   9.564  -6.249  14.583
  574    HH   TYR  79           HH       TYR  79  12.040  -3.966  13.636
  575    H    VAL  80           HN       VAL  80   8.881 -11.074   9.607
  576    HA   VAL  80           HA       VAL  80  10.889 -12.442   8.161
  577    HB   VAL  80           HB       VAL  80   9.317 -14.384   8.197
  578   1HG1  VAL  80          HG11      VAL  80   9.380 -14.651  10.642
  579   2HG1  VAL  80          HG12      VAL  80   9.772 -12.939  10.804
  580   3HG1  VAL  80          HG13      VAL  80  10.899 -14.030   9.996
  581   1HG2  VAL  80          HG21      VAL  80   7.518 -12.457   9.666
  582   2HG2  VAL  80          HG22      VAL  80   7.258 -14.195   9.508
  583   3HG2  VAL  80          HG23      VAL  80   7.209 -13.161   8.079
  584    H    ASP  81           HN       ASP  81   8.100 -10.746   7.112
  585    HA   ASP  81           HA       ASP  81   7.857 -12.151   4.590
  586   1HB   ASP  81          HB2       ASP  81   6.587  -9.539   5.433
  587   2HB   ASP  81          HB1       ASP  81   6.135 -10.514   4.046
  588    H    GLU  82           HN       GLU  82   9.184  -9.176   5.849
  589    HA   GLU  82           HA       GLU  82  10.615  -7.627   5.037
  590   1HB   GLU  82          HB2       GLU  82  11.048  -9.587   2.775
  591   2HB   GLU  82          HB1       GLU  82  12.029  -8.160   3.084
  592   1HG   GLU  82          HG2       GLU  82  12.667  -9.092   5.264
  593   2HG   GLU  82          HG1       GLU  82  11.718 -10.534   4.908
  594    H    VAL  83           HN       VAL  83   7.752  -7.837   4.256
  595    HA   VAL  83           HA       VAL  83   7.829  -6.125   1.867
  596    HB   VAL  83           HB       VAL  83   5.497  -6.670   1.470
  597   1HG1  VAL  83          HG11      VAL  83   7.195  -9.121   1.907
  598   2HG1  VAL  83          HG12      VAL  83   7.120  -8.129   0.449
  599   3HG1  VAL  83          HG13      VAL  83   5.716  -9.072   0.949
  600   1HG2  VAL  83          HG21      VAL  83   4.320  -8.369   2.802
  601   2HG2  VAL  83          HG22      VAL  83   4.730  -6.945   3.759
  602   3HG2  VAL  83          HG23      VAL  83   5.682  -8.421   3.921
  603    H    MET  84           HN       MET  84   6.612  -4.214   1.856
  604    HA   MET  84           HA       MET  84   5.719  -3.276   4.502
  605   1HB   MET  84          HB2       MET  84   7.794  -2.152   3.647
  606   2HB   MET  84          HB1       MET  84   6.857  -1.566   2.280
  607   1HG   MET  84          HG2       MET  84   5.359  -0.404   3.874
  608   2HG   MET  84          HG1       MET  84   6.434  -0.900   5.180
  609   1HE   MET  84          HE1       MET  84   5.837   1.502   2.189
  610   2HE   MET  84          HE2       MET  84   7.049   0.420   1.502
  611   3HE   MET  84          HE3       MET  84   7.458   2.103   1.837
  612    H    PHE  85           HN       PHE  85   3.622  -2.882   4.602
  613    HA   PHE  85           HA       PHE  85   2.186  -2.380   2.082
  614   1HB   PHE  85          HB2       PHE  85   0.199  -3.411   3.263
  615   2HB   PHE  85          HB1       PHE  85   1.505  -4.515   2.855
  616    HD1  PHE  85           HD1      PHE  85  -0.286  -2.841   5.562
  617    HD2  PHE  85           HD2      PHE  85   2.853  -5.539   4.574
  618    HE1  PHE  85           HE1      PHE  85  -0.211  -3.606   7.897
  619    HE2  PHE  85           HE2      PHE  85   2.936  -6.305   6.909
  620    HZ   PHE  85           HZ       PHE  85   1.402  -5.339   8.575
  621    H    ASP  86           HN       ASP  86   0.006  -1.274   2.496
  622    HA   ASP  86           HA       ASP  86   0.652   1.165   3.949
  623   1HB   ASP  86          HB2       ASP  86  -0.149   1.364   1.636
  624   2HB   ASP  86          HB1       ASP  86  -1.646   0.547   2.076
  625    H    LEU  87           HN       LEU  87  -0.364   1.897   5.704
  626    HA   LEU  87           HA       LEU  87  -2.793   0.526   6.640
  627   1HB   LEU  87          HB2       LEU  87  -0.302   1.126   8.227
  628   2HB   LEU  87          HB1       LEU  87  -1.854   0.850   8.992
  629    HG   LEU  87           HG       LEU  87  -0.373  -1.145   7.276
  630   1HD1  LEU  87          HD11      LEU  87  -0.072  -2.354   9.399
  631   2HD1  LEU  87          HD12      LEU  87  -0.791  -0.994  10.260
  632   3HD1  LEU  87          HD13      LEU  87   0.736  -0.786   9.403
  633   1HD2  LEU  87          HD21      LEU  87  -2.914  -1.418   8.881
  634   2HD2  LEU  87          HD22      LEU  87  -2.083  -2.721   8.031
  635   3HD2  LEU  87          HD23      LEU  87  -2.800  -1.391   7.121
  636    H    SER  88           HN       SER  88  -2.290   3.086   5.260
  637    HA   SER  88           HA       SER  88  -2.050   5.259   6.979
  638   1HB   SER  88          HB2       SER  88  -3.071   6.578   5.116
  639   2HB   SER  88          HB1       SER  88  -1.745   5.532   4.611
  640    HG   SER  88           HG       SER  88  -3.135   4.200   3.609
  641    H    ASP  89           HN       ASP  89  -4.962   3.513   5.993
  642    HA   ASP  89           HA       ASP  89  -6.730   5.456   7.175
  643   1HB   ASP  89          HB2       ASP  89  -7.347   2.641   6.255
  644   2HB   ASP  89          HB1       ASP  89  -8.523   3.903   6.604
  645    H    ARG  90           HN       ARG  90  -4.789   3.063   8.428
  646    HA   ARG  90           HA       ARG  90  -6.520   2.732  10.796
  647   1HB   ARG  90          HB2       ARG  90  -4.546   0.641   9.905
  648   2HB   ARG  90          HB1       ARG  90  -5.912   0.464  10.995
  649   1HG   ARG  90          HG2       ARG  90  -7.454   0.687   9.115
  650   2HG   ARG  90          HG1       ARG  90  -6.088   0.892   8.016
  651   1HD   ARG  90          HD2       ARG  90  -5.267  -1.359   8.844
  652   2HD   ARG  90          HD1       ARG  90  -6.845  -1.547   9.604
  653    HE   ARG  90           HE       ARG  90  -6.750  -0.986   6.730
  654   1HH1  ARG  90          HH11      ARG  90  -7.433  -3.213   9.352
  655   2HH1  ARG  90          HH12      ARG  90  -8.120  -4.425   8.313
  656   1HH2  ARG  90          HH21      ARG  90  -7.656  -2.579   5.364
  657   2HH2  ARG  90          HH22      ARG  90  -8.245  -4.067   6.038
  658    H    MET  91           HN       MET  91  -4.151   4.519   9.987
  659    HA   MET  91           HA       MET  91  -1.780   3.531  11.121
  660   1HB   MET  91          HB2       MET  91  -0.870   5.743  10.843
  661   2HB   MET  91          HB1       MET  91  -1.868   5.355   9.450
  662   1HG   MET  91          HG2       MET  91  -3.626   6.762  10.221
  663   2HG   MET  91          HG1       MET  91  -2.828   7.000  11.775
  664   1HE   MET  91          HE1       MET  91  -2.722   7.751   7.926
  665   2HE   MET  91          HE2       MET  91  -1.145   7.005   8.190
  666   3HE   MET  91          HE3       MET  91  -1.254   8.718   7.783
  667    H    THR  92           HN       THR  92  -0.609   4.179  12.952
  668    HA   THR  92           HA       THR  92  -2.298   4.844  15.258
  669    HB   THR  92           HB       THR  92   0.587   3.932  15.293
  670    HG1  THR  92           HG1      THR  92  -0.396   2.197  14.436
  671   1HG2  THR  92          HG21      THR  92  -0.215   4.980  17.357
  672   2HG2  THR  92          HG22      THR  92   0.059   3.253  17.589
  673   3HG2  THR  92          HG23      THR  92  -1.583   3.867  17.397
  674    HA   PRO  93           HA       PRO  93  -0.419   8.954  14.855
  675   1HB   PRO  93          HB2       PRO  93  -2.109  10.171  16.594
  676   2HB   PRO  93          HB1       PRO  93  -2.543   9.840  14.913
  677   1HG   PRO  93          HG2       PRO  93  -3.270   8.332  17.391
  678   2HG   PRO  93          HG1       PRO  93  -4.276   8.730  15.986
  679   1HD   PRO  93          HD2       PRO  93  -3.139   6.286  16.360
  680   2HD   PRO  93          HD1       PRO  93  -3.471   6.966  14.755
  681    H    HIS  94           HN       HIS  94   1.293   9.657  16.000
  682    HA   HIS  94           HA       HIS  94   2.129   8.312  18.321
  683   1HB   HIS  94          HB2       HIS  94   3.973   9.888  18.445
  684   2HB   HIS  94          HB1       HIS  94   3.728   9.368  16.784
  685    HD1  HIS  94           HD1      HIS  94   2.701  11.180  15.133
  686    HD2  HIS  94           HD2      HIS  94   3.792  12.593  18.890
  687    HE1  HIS  94           HE1      HIS  94   2.850  13.678  14.902
  688    HE2  HIS  94           HE2      HIS  94   3.345  14.522  17.227
  689    H    ASN  95           HN       ASN  95   2.138   8.801  20.436
  690    HA   ASN  95           HA       ASN  95  -0.146  10.143  21.380
  691   1HB   ASN  95          HB2       ASN  95   0.991   9.745  23.672
  692   2HB   ASN  95          HB1       ASN  95   0.497   8.357  22.713
  693   1HD2  ASN  95          HD21      ASN  95   1.961   7.039  23.796
  694   2HD2  ASN  95          HD22      ASN  95   3.663   7.103  23.464
  695    H    GLY  96           HN       GLY  96   3.304  11.010  21.822
  696   1HA   GLY  96          HA2       GLY  96   2.376  13.757  22.364
  697   2HA   GLY  96          HA1       GLY  96   3.489  12.967  23.467
  698    HA   PRO  97           HA       PRO  97   5.846  15.403  20.224
  699   1HB   PRO  97          HB2       PRO  97   7.397  16.752  22.016
  700   2HB   PRO  97          HB1       PRO  97   5.836  17.349  21.440
  701   1HG   PRO  97          HG2       PRO  97   6.494  15.916  23.985
  702   2HG   PRO  97          HG1       PRO  97   5.441  17.321  23.731
  703   1HD   PRO  97          HD2       PRO  97   4.456  14.831  24.033
  704   2HD   PRO  97          HD1       PRO  97   3.686  16.026  22.969
  705    H    ILE  98           HN       ILE  98   7.356  14.171  19.353
  706    HA   ILE  98           HA       ILE  98   9.008  12.489  21.089
  707    HB   ILE  98           HB       ILE  98   8.625  12.386  18.092
  708   1HG1  ILE  98          HG12      ILE  98   7.474  10.667  20.304
  709   2HG1  ILE  98          HG11      ILE  98   6.579  11.829  19.331
  710   1HG2  ILE  98          HG21      ILE  98   9.720  10.196  18.249
  711   2HG2  ILE  98          HG22      ILE  98  10.007  10.469  19.968
  712   3HG2  ILE  98          HG23      ILE  98  10.786  11.501  18.768
  713   1HD1  ILE  98          HD11      ILE  98   7.878   9.296  18.361
  714   2HD1  ILE  98          HD12      ILE  98   7.059  10.476  17.335
  715   3HD1  ILE  98          HD13      ILE  98   6.151   9.592  18.562
  716    HA   PRO  99           HA       PRO  99  12.418  15.312  20.405
  717   1HB   PRO  99          HB2       PRO  99  14.010  13.190  21.670
  718   2HB   PRO  99          HB1       PRO  99  13.743  14.853  22.197
  719   1HG   PRO  99          HG2       PRO  99  12.650  12.758  23.485
  720   2HG   PRO  99          HG1       PRO  99  11.824  14.321  23.355
  721   1HD   PRO  99          HD2       PRO  99  11.370  11.801  21.803
  722   2HD   PRO  99          HD1       PRO  99  10.185  12.956  22.450
  723    H    ARG 100           HN       ARG 100  12.833  15.253  18.244
  724    HA   ARG 100           HA       ARG 100  14.010  12.883  17.049
  725   1HB   ARG 100          HB2       ARG 100  12.319  14.058  15.772
  726   2HB   ARG 100          HB1       ARG 100  13.226  15.557  15.885
  727   1HG   ARG 100          HG2       ARG 100  14.613  13.261  14.641
  728   2HG   ARG 100          HG1       ARG 100  13.276  13.982  13.737
  729   1HD   ARG 100          HD2       ARG 100  14.327  16.180  13.953
  730   2HD   ARG 100          HD1       ARG 100  15.656  15.451  14.852
  731    HE   ARG 100           HE       ARG 100  16.139  14.166  12.771
  732   1HH1  ARG 100          HH11      ARG 100  14.251  17.115  12.557
  733   2HH1  ARG 100          HH12      ARG 100  14.867  17.543  10.989
  734   1HH2  ARG 100          HH21      ARG 100  16.936  14.718  10.708
  735   2HH2  ARG 100          HH22      ARG 100  16.399  16.184   9.933
  736    H    TYR 101           HN       TYR 101  16.109  12.542  17.039
  737    HA   TYR 101           HA       TYR 101  17.861  14.707  17.910
  738   1HB   TYR 101          HB2       TYR 101  18.432  11.755  17.580
  739   2HB   TYR 101          HB1       TYR 101  19.510  12.937  18.311
  740    HD1  TYR 101           HD1      TYR 101  19.054  13.818  20.546
  741    HD2  TYR 101           HD2      TYR 101  16.512  10.908  18.771
  742    HE1  TYR 101           HE1      TYR 101  18.055  13.355  22.746
  743    HE2  TYR 101           HE2      TYR 101  15.504  10.441  20.961
  744    HH   TYR 101           HH       TYR 101  16.126  10.648  23.350
  745    H    VAL 102           HN       VAL 102  17.914  12.128  15.460
  746    HA   VAL 102           HA       VAL 102  19.946  13.638  13.998
  747    HB   VAL 102           HB       VAL 102  20.255  11.553  12.666
  748   1HG1  VAL 102          HG11      VAL 102  21.397  10.304  14.445
  749   2HG1  VAL 102          HG12      VAL 102  20.548  11.267  15.655
  750   3HG1  VAL 102          HG13      VAL 102  21.696  12.039  14.561
  751   1HG2  VAL 102          HG21      VAL 102  19.290   9.462  13.451
  752   2HG2  VAL 102          HG22      VAL 102  18.013  10.591  12.998
  753   3HG2  VAL 102          HG23      VAL 102  18.391  10.322  14.699
  Start of MODEL    6
    1   1H    MET   1          HT1       MET   1   0.408   1.910  -1.797
    2   2H    MET   1          HT2       MET   1   1.326   2.676  -0.593
    3   3H    MET   1          HT3       MET   1   0.211   1.466  -0.170
    4    HA   MET   1           HA       MET   1   2.668   1.092  -1.781
    5   1HB   MET   1          HB2       MET   1   2.826   1.506   0.762
    6   2HB   MET   1          HB1       MET   1   2.064  -0.068   0.937
    7   1HG   MET   1          HG2       MET   1   4.482  -0.206   1.155
    8   2HG   MET   1          HG1       MET   1   3.903  -1.120  -0.235
    9   1HE   MET   1          HE1       MET   1   4.393   2.803   0.078
   10   2HE   MET   1          HE2       MET   1   6.050   2.958  -0.504
   11   3HE   MET   1          HE3       MET   1   5.723   2.105   1.004
   12    H    THR   2           HN       THR   2   3.059  -1.557  -1.317
   13    HA   THR   2           HA       THR   2   1.085  -2.670  -3.061
   14    HB   THR   2           HB       THR   2   3.320  -3.298  -3.515
   15    HG1  THR   2           HG1      THR   2   2.081  -5.524  -2.233
   16   1HG2  THR   2          HG21      THR   2   4.313  -2.878  -1.326
   17   2HG2  THR   2          HG22      THR   2   4.764  -4.478  -1.915
   18   3HG2  THR   2          HG23      THR   2   3.520  -4.316  -0.677
   19    H    MET   3           HN       MET   3  -0.604  -2.267  -1.326
   20    HA   MET   3           HA       MET   3  -2.223  -3.095   0.013
   21   1HB   MET   3          HB2       MET   3  -1.193  -5.715  -1.073
   22   2HB   MET   3          HB1       MET   3  -2.701  -5.526  -0.190
   23   1HG   MET   3          HG2       MET   3  -2.007  -4.247  -2.823
   24   2HG   MET   3          HG1       MET   3  -3.108  -5.601  -2.571
   25   1HE   MET   3          HE1       MET   3  -5.481  -2.628  -3.589
   26   2HE   MET   3          HE2       MET   3  -4.963  -4.269  -3.975
   27   3HE   MET   3          HE3       MET   3  -3.845  -2.921  -4.179
   28    H    GLY   4           HN       GLY   4  -0.328  -5.996   0.589
   29   1HA   GLY   4          HA2       GLY   4   1.038  -5.505   2.868
   30   2HA   GLY   4          HA1       GLY   4  -0.625  -5.608   3.431
   31    H    CYS   5           HN       CYS   5  -0.691  -7.513   4.481
   32    HA   CYS   5           HA       CYS   5  -0.522  -9.915   2.907
   33   1HB   CYS   5          HB2       CYS   5   1.112 -11.062   4.293
   34   2HB   CYS   5          HB1       CYS   5   1.831  -9.611   3.604
   35    H    ARG   6           HN       ARG   6  -0.940 -11.885   4.557
   36    HA   ARG   6           HA       ARG   6  -3.474 -11.345   5.677
   37   1HB   ARG   6          HB2       ARG   6  -3.476 -13.636   6.443
   38   2HB   ARG   6          HB1       ARG   6  -2.815 -13.559   4.819
   39   1HG   ARG   6          HG2       ARG   6  -0.561 -13.777   5.706
   40   2HG   ARG   6          HG1       ARG   6  -1.202 -13.802   7.351
   41   1HD   ARG   6          HD2       ARG   6  -2.464 -15.830   6.820
   42   2HD   ARG   6          HD1       ARG   6  -1.806 -15.808   5.186
   43    HE   ARG   6           HE       ARG   6   0.278 -15.820   7.105
   44   1HH1  ARG   6          HH11      ARG   6  -2.155 -17.869   5.671
   45   2HH1  ARG   6          HH12      ARG   6  -1.236 -19.331   5.873
   46   1HH2  ARG   6          HH21      ARG   6   1.500 -17.736   7.402
   47   2HH2  ARG   6          HH22      ARG   6   0.850 -19.256   6.859
   48    H    HIS   7           HN       HIS   7  -0.303 -11.188   7.043
   49    HA   HIS   7           HA       HIS   7  -0.960 -11.527   9.757
   50   1HB   HIS   7          HB2       HIS   7   1.294  -9.964   8.491
   51   2HB   HIS   7          HB1       HIS   7   1.159 -10.278  10.217
   52    HD2  HIS   7           HD2      HIS   7   0.778 -13.330  10.512
   53    HE1  HIS   7           HE1      HIS   7   3.821 -13.779   7.606
   54    HE2  HIS   7           HE2      HIS   7   2.363 -14.984   9.294
   55    H    VAL   8           HN       VAL   8  -1.406  -8.841   7.606
   56    HA   VAL   8           HA       VAL   8  -1.615  -6.765   9.517
   57    HB   VAL   8           HB       VAL   8  -3.205  -6.896   6.962
   58   1HG1  VAL   8          HG11      VAL   8  -3.004  -4.477   6.995
   59   2HG1  VAL   8          HG12      VAL   8  -2.055  -4.565   8.478
   60   3HG1  VAL   8          HG13      VAL   8  -3.748  -5.060   8.484
   61   1HG2  VAL   8          HG21      VAL   8  -1.316  -5.854   5.843
   62   2HG2  VAL   8          HG22      VAL   8  -0.929  -7.468   6.437
   63   3HG2  VAL   8          HG23      VAL   8  -0.352  -6.048   7.307
   64    H    ALA   9           HN       ALA   9  -3.790  -9.263   8.440
   65    HA   ALA   9           HA       ALA   9  -6.102  -8.089   9.611
   66   1HB   ALA   9          HB1       ALA   9  -5.626 -10.924   8.698
   67   2HB   ALA   9          HB2       ALA   9  -6.309  -9.619   7.727
   68   3HB   ALA   9          HB3       ALA   9  -7.192 -10.234   9.125
   69    H    GLY  10           HN       GLY  10  -3.445  -9.860  10.780
   70   1HA   GLY  10          HA2       GLY  10  -4.840 -10.879  13.127
   71   2HA   GLY  10          HA1       GLY  10  -3.149 -11.140  12.723
   72    H    ILE  11           HN       ILE  11  -2.942  -8.150  12.199
   73    HA   ILE  11           HA       ILE  11  -2.396  -7.413  14.967
   74    HB   ILE  11           HB       ILE  11  -1.245  -5.446  14.065
   75   1HG1  ILE  11          HG12      ILE  11  -1.895  -6.573  11.333
   76   2HG1  ILE  11          HG11      ILE  11  -2.696  -5.180  12.051
   77   1HG2  ILE  11          HG21      ILE  11  -0.416  -8.024  12.744
   78   2HG2  ILE  11          HG22      ILE  11  -0.002  -7.514  14.380
   79   3HG2  ILE  11          HG23      ILE  11   0.616  -6.616  12.993
   80   1HD1  ILE  11          HD11      ILE  11  -0.572  -3.979  12.086
   81   2HD1  ILE  11          HD12      ILE  11  -0.998  -4.503  10.456
   82   3HD1  ILE  11          HD13      ILE  11   0.227  -5.379  11.373
   83    H    ARG  12           HN       ARG  12  -3.091  -5.391  15.844
   84    HA   ARG  12           HA       ARG  12  -5.485  -4.277  14.574
   85   1HB   ARG  12          HB2       ARG  12  -6.431  -4.123  16.986
   86   2HB   ARG  12          HB1       ARG  12  -6.545  -5.643  16.116
   87   1HG   ARG  12          HG2       ARG  12  -5.899  -6.197  18.301
   88   2HG   ARG  12          HG1       ARG  12  -4.441  -6.347  17.324
   89   1HD   ARG  12          HD2       ARG  12  -3.927  -5.263  19.418
   90   2HD   ARG  12          HD1       ARG  12  -3.725  -4.126  18.086
   91    HE   ARG  12           HE       ARG  12  -6.063  -3.342  18.756
   92   1HH1  ARG  12          HH11      ARG  12  -3.740  -4.668  21.025
   93   2HH1  ARG  12          HH12      ARG  12  -4.360  -3.774  22.376
   94   1HH2  ARG  12          HH21      ARG  12  -6.851  -2.140  20.534
   95   2HH2  ARG  12          HH22      ARG  12  -6.115  -2.338  22.100
   96    H    THR  13           HN       THR  13  -6.181  -2.210  15.801
   97    HA   THR  13           HA       THR  13  -3.924  -0.466  15.787
   98    HB   THR  13           HB       THR  13  -6.771   0.144  16.607
   99    HG1  THR  13           HG1      THR  13  -6.858   0.897  14.372
  100   1HG2  THR  13          HG21      THR  13  -6.187   2.457  16.035
  101   2HG2  THR  13          HG22      THR  13  -4.533   1.958  15.680
  102   3HG2  THR  13          HG23      THR  13  -5.151   1.851  17.329
  103    H    VAL  14           HN       VAL  14  -2.533  -0.831  17.375
  104    HA   VAL  14           HA       VAL  14  -3.387  -1.249  20.102
  105    HB   VAL  14           HB       VAL  14  -0.939  -1.427  20.567
  106   1HG1  VAL  14          HG11      VAL  14  -0.603  -3.522  19.322
  107   2HG1  VAL  14          HG12      VAL  14  -2.001  -3.129  18.319
  108   3HG1  VAL  14          HG13      VAL  14  -2.208  -3.416  20.047
  109   1HG2  VAL  14          HG21      VAL  14  -0.691  -1.036  17.585
  110   2HG2  VAL  14          HG22      VAL  14   0.611  -1.527  18.668
  111   3HG2  VAL  14          HG23      VAL  14  -0.116   0.072  18.832
  112    H    THR  15           HN       THR  15  -2.490   0.013  21.872
  113    HA   THR  15           HA       THR  15  -2.377   2.861  21.232
  114    HB   THR  15           HB       THR  15  -2.577   1.490  23.925
  115    HG1  THR  15           HG1      THR  15  -4.438   2.038  21.999
  116   1HG2  THR  15          HG21      THR  15  -1.607   3.729  24.077
  117   2HG2  THR  15          HG22      THR  15  -3.237   3.704  24.753
  118   3HG2  THR  15          HG23      THR  15  -2.956   4.385  23.150
  119    HA   PRO  16           HA       PRO  16   2.085   2.843  21.554
  120   1HB   PRO  16          HB2       PRO  16   1.599   5.685  22.289
  121   2HB   PRO  16          HB1       PRO  16   2.668   5.008  21.056
  122   1HG   PRO  16          HG2       PRO  16   0.380   6.179  20.367
  123   2HG   PRO  16          HG1       PRO  16   0.943   4.720  19.530
  124   1HD   PRO  16          HD2       PRO  16  -1.190   5.014  21.602
  125   2HD   PRO  16          HD1       PRO  16  -1.145   3.968  20.168
  126    H    SER  17           HN       SER  17   2.695   1.768  23.340
  127    HA   SER  17           HA       SER  17   1.987   2.677  25.986
  128   1HB   SER  17          HB2       SER  17   2.150   0.247  25.250
  129   2HB   SER  17          HB1       SER  17   3.899   0.452  25.254
  130    HG   SER  17           HG       SER  17   3.014   1.373  27.566
  131    H    ALA  18           HN       ALA  18   3.965   4.005  23.961
  132    HA   ALA  18           HA       ALA  18   5.630   5.185  25.958
  133   1HB   ALA  18          HB1       ALA  18   6.974   3.198  25.570
  134   2HB   ALA  18          HB2       ALA  18   7.787   4.608  24.891
  135   3HB   ALA  18          HB3       ALA  18   6.939   3.483  23.830
  136    H    LEU  19           HN       LEU  19   6.587   7.117  25.198
  137    HA   LEU  19           HA       LEU  19   5.287   8.225  22.864
  138   1HB   LEU  19          HB2       LEU  19   7.078   9.307  25.005
  139   2HB   LEU  19          HB1       LEU  19   6.848  10.225  23.531
  140    HG   LEU  19           HG       LEU  19   4.440  10.346  23.955
  141   1HD1  LEU  19          HD11      LEU  19   5.046   8.883  26.519
  142   2HD1  LEU  19          HD12      LEU  19   4.149   8.234  25.146
  143   3HD1  LEU  19          HD13      LEU  19   3.494   9.589  26.066
  144   1HD2  LEU  19          HD21      LEU  19   5.868  12.106  24.818
  145   2HD2  LEU  19          HD22      LEU  19   6.128  11.191  26.303
  146   3HD2  LEU  19          HD23      LEU  19   4.522  11.808  25.918
  147    H    GLY  20           HN       GLY  20   8.616   7.623  23.880
  148   1HA   GLY  20          HA2       GLY  20   9.339   7.415  21.031
  149   2HA   GLY  20          HA1       GLY  20  10.425   8.111  22.229
  150    H    CYS  21           HN       CYS  21  12.053   6.573  21.886
  151    HA   CYS  21           HA       CYS  21  11.516   3.777  22.210
  152   1HB   CYS  21          HB2       CYS  21  14.123   5.309  22.276
  153   2HB   CYS  21          HB1       CYS  21  13.990   3.554  22.283
  154    HG   CYS  21           HG       CYS  21  12.258   4.522  19.746
  155    H    GLU  22           HN       GLU  22  10.699   3.196  24.129
  156    HA   GLU  22           HA       GLU  22  11.090   4.301  26.621
  157   1HB   GLU  22          HB2       GLU  22   9.435   2.540  26.071
  158   2HB   GLU  22          HB1       GLU  22  10.738   1.365  25.982
  159   1HG   GLU  22          HG2       GLU  22  11.250   1.938  28.385
  160   2HG   GLU  22          HG1       GLU  22   9.726   2.826  28.399
  161    H    GLU  23           HN       GLU  23  13.027   1.930  24.925
  162    HA   GLU  23           HA       GLU  23  14.845   1.248  26.927
  163   1HB   GLU  23          HB2       GLU  23  14.424   0.465  24.382
  164   2HB   GLU  23          HB1       GLU  23  15.848   1.469  24.148
  165   1HG   GLU  23          HG2       GLU  23  16.497  -0.820  24.463
  166   2HG   GLU  23          HG1       GLU  23  17.037   0.150  25.831
  167    H    CYS  24           HN       CYS  24  15.439   3.507  24.226
  168    HA   CYS  24           HA       CYS  24  17.677   4.774  25.184
  169   1HB   CYS  24          HB2       CYS  24  15.391   5.991  23.625
  170   2HB   CYS  24          HB1       CYS  24  16.982   6.719  23.808
  171    HG   CYS  24           HG       CYS  24  17.800   5.715  21.608
  172    H    LEU  25           HN       LEU  25  14.302   5.443  26.008
  173    HA   LEU  25           HA       LEU  25  14.860   7.862  27.400
  174   1HB   LEU  25          HB2       LEU  25  12.445   6.065  27.394
  175   2HB   LEU  25          HB1       LEU  25  12.516   7.589  28.258
  176    HG   LEU  25           HG       LEU  25  12.811   7.274  25.268
  177   1HD1  LEU  25          HD11      LEU  25  10.504   8.288  26.925
  178   2HD1  LEU  25          HD12      LEU  25  10.544   6.791  25.993
  179   3HD1  LEU  25          HD13      LEU  25  10.609   8.347  25.165
  180   1HD2  LEU  25          HD21      LEU  25  12.659   9.711  25.225
  181   2HD2  LEU  25          HD22      LEU  25  14.059   9.176  26.154
  182   3HD2  LEU  25          HD23      LEU  25  12.614   9.745  26.988
  183    H    LYS  26           HN       LYS  26  15.209   4.581  28.316
  184    HA   LYS  26           HA       LYS  26  14.829   5.100  31.142
  185   1HB   LYS  26          HB2       LYS  26  15.199   2.810  31.505
  186   2HB   LYS  26          HB1       LYS  26  14.392   2.858  29.943
  187   1HG   LYS  26          HG2       LYS  26  16.862   2.904  29.044
  188   2HG   LYS  26          HG1       LYS  26  17.205   2.176  30.613
  189   1HD   LYS  26          HD2       LYS  26  15.127   1.122  28.709
  190   2HD   LYS  26          HD1       LYS  26  16.798   0.563  28.728
  191   1HE   LYS  26          HE2       LYS  26  16.535  -0.152  31.045
  192   2HE   LYS  26          HE1       LYS  26  14.866   0.425  31.038
  193   1HZ   LYS  26          HZ1       LYS  26  15.774  -1.544  29.037
  194   2HZ   LYS  26          HZ2       LYS  26  14.203  -1.247  29.607
  195   3HZ   LYS  26          HZ3       LYS  26  15.326  -2.048  30.592
  196    H    ILE  27           HN       ILE  27  17.343   5.393  28.855
  197    HA   ILE  27           HA       ILE  27  19.342   5.572  31.015
  198    HB   ILE  27           HB       ILE  27  21.064   5.055  29.289
  199   1HG1  ILE  27          HG12      ILE  27  18.633   4.449  27.587
  200   2HG1  ILE  27          HG11      ILE  27  19.847   5.684  27.282
  201   1HG2  ILE  27          HG21      ILE  27  20.281   3.335  30.801
  202   2HG2  ILE  27          HG22      ILE  27  20.593   2.645  29.208
  203   3HG2  ILE  27          HG23      ILE  27  18.937   2.966  29.721
  204   1HD1  ILE  27          HD11      ILE  27  20.167   3.765  25.838
  205   2HD1  ILE  27          HD12      ILE  27  20.308   2.710  27.244
  206   3HD1  ILE  27          HD13      ILE  27  21.529   3.946  26.943
  207    H    GLY  28           HN       GLY  28  17.587   7.375  28.848
  208   1HA   GLY  28          HA2       GLY  28  17.675   9.649  28.437
  209   2HA   GLY  28          HA1       GLY  28  19.163   9.718  29.370
  210    H    SER  29           HN       SER  29  18.406   7.802  26.497
  211    HA   SER  29           HA       SER  29  20.612   9.171  25.105
  212   1HB   SER  29          HB2       SER  29  19.772   6.266  24.973
  213   2HB   SER  29          HB1       SER  29  20.991   6.996  23.931
  214    HG   SER  29           HG       SER  29  21.908   7.674  26.138
  215    HA   PRO  30           HA       PRO  30  17.719   9.944  21.834
  216   1HB   PRO  30          HB2       PRO  30  19.364  10.304  19.747
  217   2HB   PRO  30          HB1       PRO  30  19.324  11.436  21.103
  218   1HG   PRO  30          HG2       PRO  30  21.288   9.269  20.499
  219   2HG   PRO  30          HG1       PRO  30  21.576  10.900  21.130
  220   1HD   PRO  30          HD2       PRO  30  21.485   8.614  22.673
  221   2HD   PRO  30          HD1       PRO  30  21.192  10.254  23.283
  222    H    TRP  31           HN       TRP  31  17.320   9.295  19.441
  223    HA   TRP  31           HA       TRP  31  18.088   6.561  18.827
  224   1HB   TRP  31          HB2       TRP  31  15.727   5.885  18.431
  225   2HB   TRP  31          HB1       TRP  31  16.069   6.209  20.125
  226    HD1  TRP  31           HD1      TRP  31  14.289   7.854  17.099
  227    HE1  TRP  31           HE1      TRP  31  12.465   9.423  18.006
  228    HE3  TRP  31           HE3      TRP  31  15.287   7.459  22.100
  229    HZ2  TRP  31           HZ2      TRP  31  11.562  10.366  20.506
  230    HZ3  TRP  31           HZ3      TRP  31  13.891   8.725  23.682
  231    HH2  TRP  31           HH2      TRP  31  12.067  10.148  22.901
  232    H    VAL  32           HN       VAL  32  17.368   5.939  16.612
  233    HA   VAL  32           HA       VAL  32  17.480   8.245  14.840
  234    HB   VAL  32           HB       VAL  32  17.479   5.305  14.122
  235   1HG1  VAL  32          HG11      VAL  32  18.323   6.060  11.954
  236   2HG1  VAL  32          HG12      VAL  32  18.177   7.737  12.479
  237   3HG1  VAL  32          HG13      VAL  32  16.733   6.742  12.295
  238   1HG2  VAL  32          HG21      VAL  32  19.803   7.217  14.325
  239   2HG2  VAL  32          HG22      VAL  32  19.877   5.524  13.835
  240   3HG2  VAL  32          HG23      VAL  32  19.425   5.945  15.487
  241    H    HIS  33           HN       HIS  33  15.523   5.245  14.830
  242    HA   HIS  33           HA       HIS  33  13.190   6.904  14.197
  243   1HB   HIS  33          HB2       HIS  33  14.082   4.433  12.715
  244   2HB   HIS  33          HB1       HIS  33  12.432   5.037  12.637
  245    HD1  HIS  33           HD1      HIS  33  12.361   7.742  11.865
  246    HD2  HIS  33           HD2      HIS  33  15.634   5.416  10.740
  247    HE1  HIS  33           HE1      HIS  33  13.431   8.947   9.934
  248    HE2  HIS  33           HE2      HIS  33  15.506   7.624   9.391
  249    H    LEU  34           HN       LEU  34  11.154   5.963  14.671
  250    HA   LEU  34           HA       LEU  34  11.303   4.210  17.030
  251   1HB   LEU  34          HB2       LEU  34   9.136   6.084  16.082
  252   2HB   LEU  34          HB1       LEU  34   9.026   5.075  17.510
  253    HG   LEU  34           HG       LEU  34  11.013   7.309  17.104
  254   1HD1  LEU  34          HD11      LEU  34   9.698   8.459  18.812
  255   2HD1  LEU  34          HD12      LEU  34   8.545   7.125  18.822
  256   3HD1  LEU  34          HD13      LEU  34   8.732   8.118  17.377
  257   1HD2  LEU  34          HD21      LEU  34  11.875   5.505  18.506
  258   2HD2  LEU  34          HD22      LEU  34  10.422   5.585  19.504
  259   3HD2  LEU  34          HD23      LEU  34  11.537   6.951  19.456
  260    H    ARG  35           HN       ARG  35  10.430   2.236  16.987
  261    HA   ARG  35           HA       ARG  35   8.597   1.608  14.766
  262   1HB   ARG  35          HB2       ARG  35  10.403  -0.403  16.109
  263   2HB   ARG  35          HB1       ARG  35   9.501  -0.588  14.612
  264   1HG   ARG  35          HG2       ARG  35  11.866   1.225  15.039
  265   2HG   ARG  35          HG1       ARG  35  11.877  -0.318  14.190
  266   1HD   ARG  35          HD2       ARG  35  10.181   2.026  13.356
  267   2HD   ARG  35          HD1       ARG  35  11.801   1.732  12.730
  268    HE   ARG  35           HE       ARG  35   9.638  -0.242  12.423
  269   1HH1  ARG  35          HH11      ARG  35  12.193   1.741  11.066
  270   2HH1  ARG  35          HH12      ARG  35  12.073   1.028   9.492
  271   1HH2  ARG  35          HH21      ARG  35   9.501  -1.182  10.331
  272   2HH2  ARG  35          HH22      ARG  35  10.559  -0.622   9.069
  273    H    ILE  36           HN       ILE  36   6.618   1.501  15.597
  274    HA   ILE  36           HA       ILE  36   6.282   0.480  18.328
  275    HB   ILE  36           HB       ILE  36   5.170   2.594  17.910
  276   1HG1  ILE  36          HG12      ILE  36   3.145   0.353  18.076
  277   2HG1  ILE  36          HG11      ILE  36   4.118   0.933  19.424
  278   1HG2  ILE  36          HG21      ILE  36   3.349   2.823  16.306
  279   2HG2  ILE  36          HG22      ILE  36   3.634   1.177  15.742
  280   3HG2  ILE  36          HG23      ILE  36   4.865   2.416  15.501
  281   1HD1  ILE  36          HD11      ILE  36   1.865   1.833  19.498
  282   2HD1  ILE  36          HD12      ILE  36   2.085   2.543  17.898
  283   3HD1  ILE  36          HD13      ILE  36   3.053   3.115  19.256
  284    H    CYS  37           HN       CYS  37   5.666  -1.437  18.698
  285    HA   CYS  37           HA       CYS  37   5.299  -3.305  16.571
  286   1HB   CYS  37          HB2       CYS  37   6.554  -3.733  18.656
  287   2HB   CYS  37          HB1       CYS  37   5.054  -3.616  19.564
  288    H    ARG  38           HN       ARG  38   3.415  -3.733  15.590
  289    HA   ARG  38           HA       ARG  38   0.989  -2.525  16.495
  290   1HB   ARG  38          HB2       ARG  38   1.559  -4.405  14.206
  291   2HB   ARG  38          HB1       ARG  38  -0.014  -3.687  14.509
  292   1HG   ARG  38          HG2       ARG  38   2.506  -2.132  13.969
  293   2HG   ARG  38          HG1       ARG  38   1.260  -2.502  12.775
  294   1HD   ARG  38          HD2       ARG  38   1.011  -0.793  15.242
  295   2HD   ARG  38          HD1       ARG  38   0.854  -0.290  13.560
  296    HE   ARG  38           HE       ARG  38  -1.057  -2.187  14.746
  297   1HH1  ARG  38          HH11      ARG  38  -0.380   0.830  13.085
  298   2HH1  ARG  38          HH12      ARG  38  -2.066   1.216  12.890
  299   1HH2  ARG  38          HH21      ARG  38  -3.257  -1.666  14.435
  300   2HH2  ARG  38          HH22      ARG  38  -3.681  -0.187  13.630
  301    H    THR  39           HN       THR  39   2.387  -5.244  17.621
  302    HA   THR  39           HA       THR  39  -0.105  -6.752  17.842
  303    HB   THR  39           HB       THR  39   2.548  -7.650  18.937
  304    HG1  THR  39           HG1      THR  39   1.775  -8.432  16.362
  305   1HG2  THR  39          HG21      THR  39   1.624  -9.874  18.435
  306   2HG2  THR  39          HG22      THR  39   0.154  -9.118  17.820
  307   3HG2  THR  39          HG23      THR  39   0.579  -8.964  19.526
  308    H    CYS  40           HN       CYS  40   2.549  -5.780  20.023
  309    HA   CYS  40           HA       CYS  40   0.672  -5.992  22.261
  310   1HB   CYS  40          HB2       CYS  40   2.655  -6.199  23.690
  311   2HB   CYS  40          HB1       CYS  40   2.704  -7.376  22.384
  312    H    GLY  41           HN       GLY  41   1.809  -3.661  20.267
  313   1HA   GLY  41          HA2       GLY  41   1.437  -1.398  20.355
  314   2HA   GLY  41          HA1       GLY  41   0.774  -1.622  21.962
  315    H    HIS  42           HN       HIS  42   3.994  -2.803  21.570
  316    HA   HIS  42           HA       HIS  42   4.845  -0.584  23.271
  317   1HB   HIS  42          HB2       HIS  42   5.276  -3.069  23.833
  318   2HB   HIS  42          HB1       HIS  42   6.559  -2.970  22.628
  319    HD1  HIS  42           HD1      HIS  42   8.747  -2.581  23.722
  320    HD2  HIS  42           HD2      HIS  42   5.651  -0.658  25.728
  321    HE1  HIS  42           HE1      HIS  42   9.830  -1.360  25.636
  322    HE2  HIS  42           HE2      HIS  42   7.932  -0.274  26.890
  323    H    VAL  43           HN       VAL  43   6.258   0.929  22.689
  324    HA   VAL  43           HA       VAL  43   7.193   0.966  19.931
  325    HB   VAL  43           HB       VAL  43   7.553   3.105  22.041
  326   1HG1  VAL  43          HG11      VAL  43   7.819   4.602  20.128
  327   2HG1  VAL  43          HG12      VAL  43   7.625   3.237  19.028
  328   3HG1  VAL  43          HG13      VAL  43   9.019   3.311  20.105
  329   1HG2  VAL  43          HG21      VAL  43   5.578   4.209  21.048
  330   2HG2  VAL  43          HG22      VAL  43   5.181   2.679  21.830
  331   3HG2  VAL  43          HG23      VAL  43   5.290   2.769  20.071
  332    H    GLY  44           HN       GLY  44   9.271   0.640  19.342
  333   1HA   GLY  44          HA2       GLY  44  11.330   0.647  21.453
  334   2HA   GLY  44          HA1       GLY  44  11.189  -0.725  20.361
  335    H    CYS  45           HN       CYS  45  13.576   0.485  20.431
  336    HA   CYS  45           HA       CYS  45  13.735   2.521  18.394
  337   1HB   CYS  45          HB2       CYS  45  16.229   2.231  18.745
  338   2HB   CYS  45          HB1       CYS  45  15.310   2.770  20.145
  339    HG   CYS  45           HG       CYS  45  17.214   1.075  21.127
  340    H    CYS  46           HN       CYS  46  14.353   2.296  16.345
  341    HA   CYS  46           HA       CYS  46  14.023  -0.205  15.078
  342   1HB   CYS  46          HB2       CYS  46  13.580   2.086  14.094
  343   2HB   CYS  46          HB1       CYS  46  15.320   2.255  13.898
  344    HG   CYS  46           HG       CYS  46  15.334   1.246  11.557
  345    H    ASP  47           HN       ASP  47  15.744  -0.922  13.384
  346    HA   ASP  47           HA       ASP  47  18.020  -1.760  14.911
  347   1HB   ASP  47          HB2       ASP  47  18.593  -3.120  12.991
  348   2HB   ASP  47          HB1       ASP  47  16.864  -3.252  13.291
  349    H    ASP  48           HN       ASP  48  17.340   0.931  13.034
  350    HA   ASP  48           HA       ASP  48  19.787   1.584  11.865
  351   1HB   ASP  48          HB2       ASP  48  17.752   3.408  13.170
  352   2HB   ASP  48          HB1       ASP  48  19.078   3.959  12.153
  353    H    SER  49           HN       SER  49  18.599   2.133  15.153
  354    HA   SER  49           HA       SER  49  21.192   3.012  16.080
  355   1HB   SER  49          HB2       SER  49  18.713   2.252  17.656
  356   2HB   SER  49          HB1       SER  49  20.129   3.089  18.290
  357    HG   SER  49           HG       SER  49  19.582   4.893  17.202
  358    HA   PRO  50           HA       PRO  50  22.920  -1.007  16.397
  359   1HB   PRO  50          HB2       PRO  50  24.586  -0.592  18.571
  360   2HB   PRO  50          HB1       PRO  50  24.965  -0.168  16.899
  361   1HG   PRO  50          HG2       PRO  50  23.933   1.558  19.107
  362   2HG   PRO  50          HG1       PRO  50  25.135   1.930  17.858
  363   1HD   PRO  50          HD2       PRO  50  22.623   2.841  17.689
  364   2HD   PRO  50          HD1       PRO  50  23.516   2.325  16.242
  365    H    HIS  51           HN       HIS  51  21.211   0.379  19.038
  366    HA   HIS  51           HA       HIS  51  21.305  -1.748  20.889
  367   1HB   HIS  51          HB2       HIS  51  20.370   0.718  21.031
  368   2HB   HIS  51          HB1       HIS  51  18.864  -0.052  20.555
  369    HD1  HIS  51           HD1      HIS  51  19.912   1.294  23.385
  370    HD2  HIS  51           HD2      HIS  51  19.028  -2.683  22.545
  371    HE1  HIS  51           HE1      HIS  51  19.234   0.282  25.577
  372    HE2  HIS  51           HE2      HIS  51  18.755  -2.150  25.071
  373    H    LYS  52           HN       LYS  52  19.202  -1.013  18.160
  374    HA   LYS  52           HA       LYS  52  17.593  -2.175  17.045
  375   1HB   LYS  52          HB2       LYS  52  19.435  -4.484  17.675
  376   2HB   LYS  52          HB1       LYS  52  18.260  -4.421  16.370
  377   1HG   LYS  52          HG2       LYS  52  19.535  -2.464  15.452
  378   2HG   LYS  52          HG1       LYS  52  20.775  -2.801  16.658
  379   1HD   LYS  52          HD2       LYS  52  19.807  -4.730  14.550
  380   2HD   LYS  52          HD1       LYS  52  21.305  -3.803  14.480
  381   1HE   LYS  52          HE2       LYS  52  22.142  -4.935  16.444
  382   2HE   LYS  52          HE1       LYS  52  20.614  -5.794  16.634
  383   1HZ   LYS  52          HZ1       LYS  52  22.432  -7.094  15.559
  384   2HZ   LYS  52          HZ2       LYS  52  22.331  -6.045  14.233
  385   3HZ   LYS  52          HZ3       LYS  52  21.002  -7.005  14.652
  386    H    HIS  53           HN       HIS  53  16.503  -1.772  19.450
  387    HA   HIS  53           HA       HIS  53  15.952  -4.229  20.831
  388   1HB   HIS  53          HB2       HIS  53  16.034  -1.930  21.910
  389   2HB   HIS  53          HB1       HIS  53  14.457  -1.632  21.185
  390    HD1  HIS  53           HD1      HIS  53  12.459  -2.462  22.468
  391    HD2  HIS  53           HD2      HIS  53  16.014  -4.148  23.800
  392    HE1  HIS  53           HE1      HIS  53  11.856  -3.761  24.530
  393    HE2  HIS  53           HE2      HIS  53  14.067  -4.535  25.458
  394    H    ALA  54           HN       ALA  54  14.531  -2.557  18.182
  395    HA   ALA  54           HA       ALA  54  11.896  -3.630  18.426
  396   1HB   ALA  54          HB1       ALA  54  13.305  -2.559  15.983
  397   2HB   ALA  54          HB2       ALA  54  12.350  -1.610  17.123
  398   3HB   ALA  54          HB3       ALA  54  11.572  -2.849  16.137
  399    H    THR  55           HN       THR  55  14.778  -4.572  16.587
  400    HA   THR  55           HA       THR  55  13.497  -6.786  15.320
  401    HB   THR  55           HB       THR  55  15.892  -7.413  14.723
  402    HG1  THR  55           HG1      THR  55  17.492  -5.983  15.258
  403   1HG2  THR  55          HG21      THR  55  14.465  -6.141  13.204
  404   2HG2  THR  55          HG22      THR  55  16.127  -5.558  13.127
  405   3HG2  THR  55          HG23      THR  55  14.914  -4.643  14.020
  406    H    ARG  56           HN       ARG  56  15.768  -6.424  18.022
  407    HA   ARG  56           HA       ARG  56  15.979  -9.124  18.726
  408   1HB   ARG  56          HB2       ARG  56  16.198  -6.584  20.329
  409   2HB   ARG  56          HB1       ARG  56  16.429  -8.163  21.067
  410   1HG   ARG  56          HG2       ARG  56  18.329  -8.615  19.744
  411   2HG   ARG  56          HG1       ARG  56  17.993  -7.259  18.667
  412   1HD   ARG  56          HD2       ARG  56  19.845  -6.825  20.258
  413   2HD   ARG  56          HD1       ARG  56  18.515  -5.680  20.396
  414    HE   ARG  56           HE       ARG  56  17.953  -7.607  22.258
  415   1HH1  ARG  56          HH11      ARG  56  20.753  -5.592  21.612
  416   2HH1  ARG  56          HH12      ARG  56  21.159  -5.411  23.297
  417   1HH2  ARG  56          HH21      ARG  56  18.493  -7.367  24.458
  418   2HH2  ARG  56          HH22      ARG  56  19.888  -6.435  24.912
  419    H    HIS  57           HN       HIS  57  13.460  -6.792  19.291
  420    HA   HIS  57           HA       HIS  57  12.037  -8.180  21.296
  421   1HB   HIS  57          HB2       HIS  57  11.580  -5.842  20.858
  422   2HB   HIS  57          HB1       HIS  57  11.088  -6.208  19.207
  423    HD1  HIS  57           HD1      HIS  57   9.941  -6.798  22.783
  424    HD2  HIS  57           HD2      HIS  57   8.462  -6.798  18.894
  425    HE1  HIS  57           HE1      HIS  57   7.438  -7.103  22.969
  426    H    PHE  58           HN       PHE  58  11.875  -8.254  17.763
  427    HA   PHE  58           HA       PHE  58   9.633  -9.943  17.547
  428   1HB   PHE  58          HB2       PHE  58  10.346  -8.716  15.620
  429   2HB   PHE  58          HB1       PHE  58  11.953  -9.431  15.682
  430    HD1  PHE  58           HD1      PHE  58   8.451 -10.750  15.632
  431    HD2  PHE  58           HD2      PHE  58  12.354 -10.869  13.972
  432    HE1  PHE  58           HE1      PHE  58   7.729 -12.513  14.077
  433    HE2  PHE  58           HE2      PHE  58  11.646 -12.632  12.411
  434    HZ   PHE  58           HZ       PHE  58   9.330 -13.458  12.464
  435    H    HIS  59           HN       HIS  59  13.067 -10.589  17.882
  436    HA   HIS  59           HA       HIS  59  12.914 -13.383  17.451
  437   1HB   HIS  59          HB2       HIS  59  14.960 -11.608  18.759
  438   2HB   HIS  59          HB1       HIS  59  15.148 -13.358  18.731
  439    HD1  HIS  59           HD1      HIS  59  16.769 -13.945  16.974
  440    HD2  HIS  59           HD2      HIS  59  14.276 -10.834  15.784
  441    HE1  HIS  59           HE1      HIS  59  17.436 -13.404  14.609
  442    HE2  HIS  59           HE2      HIS  59  15.803 -11.641  13.855
  443    H    ALA  60           HN       ALA  60  12.255 -11.382  20.195
  444    HA   ALA  60           HA       ALA  60  12.377 -13.605  22.058
  445   1HB   ALA  60          HB1       ALA  60  13.198 -11.381  22.722
  446   2HB   ALA  60          HB2       ALA  60  11.914 -11.971  23.777
  447   3HB   ALA  60          HB3       ALA  60  11.559 -10.749  22.557
  448    H    THR  61           HN       THR  61   9.881 -11.377  20.801
  449    HA   THR  61           HA       THR  61   7.846 -12.886  22.262
  450    HB   THR  61           HB       THR  61   6.306 -11.046  21.415
  451    HG1  THR  61           HG1      THR  61   8.832  -9.921  20.702
  452   1HG2  THR  61          HG21      THR  61   7.031  -9.457  23.099
  453   2HG2  THR  61          HG22      THR  61   8.637 -10.193  23.135
  454   3HG2  THR  61          HG23      THR  61   7.236 -11.104  23.701
  455    H    GLY  62           HN       GLY  62   8.965 -12.433  19.005
  456   1HA   GLY  62          HA2       GLY  62   8.309 -13.519  17.071
  457   2HA   GLY  62          HA1       GLY  62   7.089 -14.371  18.008
  458    H    HIS  63           HN       HIS  63   7.529 -10.880  17.669
  459    HA   HIS  63           HA       HIS  63   4.809 -10.726  16.544
  460   1HB   HIS  63          HB2       HIS  63   6.400  -8.669  18.097
  461   2HB   HIS  63          HB1       HIS  63   4.841  -8.351  17.352
  462    HD2  HIS  63           HD2      HIS  63   4.288 -11.688  18.778
  463    HE1  HIS  63           HE1      HIS  63   3.586  -8.990  21.972
  464    HE2  HIS  63           HE2      HIS  63   3.478 -11.431  21.235
  465    HA   PRO  64           HA       PRO  64   7.485  -9.892  13.086
  466   1HB   PRO  64          HB2       PRO  64   5.830 -10.620  11.135
  467   2HB   PRO  64          HB1       PRO  64   6.472 -11.801  12.284
  468   1HG   PRO  64          HG2       PRO  64   3.785 -10.477  12.231
  469   2HG   PRO  64          HG1       PRO  64   4.188 -12.176  12.542
  470   1HD   PRO  64          HD2       PRO  64   3.687 -10.304  14.506
  471   2HD   PRO  64          HD1       PRO  64   4.640 -11.781  14.747
  472    H    ILE  65           HN       ILE  65   4.938  -7.833  13.921
  473    HA   ILE  65           HA       ILE  65   5.479  -6.234  11.511
  474    HB   ILE  65           HB       ILE  65   2.785  -6.519  12.843
  475   1HG1  ILE  65          HG12      ILE  65   3.834  -7.303  10.111
  476   2HG1  ILE  65          HG11      ILE  65   3.299  -8.393  11.385
  477   1HG2  ILE  65          HG21      ILE  65   1.983  -4.975  11.102
  478   2HG2  ILE  65          HG22      ILE  65   3.643  -4.740  10.559
  479   3HG2  ILE  65          HG23      ILE  65   3.158  -4.211  12.171
  480   1HD1  ILE  65          HD11      ILE  65   1.020  -7.547  11.136
  481   2HD1  ILE  65          HD12      ILE  65   1.643  -8.216   9.627
  482   3HD1  ILE  65          HD13      ILE  65   1.566  -6.468   9.852
  483    H    ILE  66           HN       ILE  66   6.202  -4.301  11.822
  484    HA   ILE  66           HA       ILE  66   5.617  -2.890  14.339
  485    HB   ILE  66           HB       ILE  66   7.888  -1.888  14.246
  486   1HG1  ILE  66          HG12      ILE  66   8.492  -4.057  12.226
  487   2HG1  ILE  66          HG11      ILE  66   8.249  -2.365  11.807
  488   1HG2  ILE  66          HG21      ILE  66   7.868  -4.890  14.455
  489   2HG2  ILE  66          HG22      ILE  66   7.378  -3.769  15.725
  490   3HG2  ILE  66          HG23      ILE  66   9.055  -3.803  15.176
  491   1HD1  ILE  66          HD11      ILE  66  10.408  -3.426  13.613
  492   2HD1  ILE  66          HD12      ILE  66  10.176  -1.742  13.137
  493   3HD1  ILE  66          HD13      ILE  66  10.610  -2.950  11.926
  494    H    GLU  67           HN       GLU  67   5.138  -0.749  14.124
  495    HA   GLU  67           HA       GLU  67   4.895   0.235  11.366
  496   1HB   GLU  67          HB2       GLU  67   2.804   0.073  12.618
  497   2HB   GLU  67          HB1       GLU  67   3.475   1.059  13.905
  498   1HG   GLU  67          HG2       GLU  67   3.565   2.976  12.446
  499   2HG   GLU  67          HG1       GLU  67   3.011   1.998  11.086
  500    H    GLY  68           HN       GLY  68   5.609   2.307  10.814
  501   1HA   GLY  68          HA2       GLY  68   7.823   3.347  12.317
  502   2HA   GLY  68          HA1       GLY  68   7.114   4.063  10.873
  503    H    TYR  69           HN       TYR  69   7.525   4.407  14.171
  504    HA   TYR  69           HA       TYR  69   4.962   5.719  14.622
  505   1HB   TYR  69          HB2       TYR  69   5.861   4.058  16.254
  506   2HB   TYR  69          HB1       TYR  69   7.180   5.171  16.599
  507    HD1  TYR  69           HD1      TYR  69   6.871   5.924  18.762
  508    HD2  TYR  69           HD2      TYR  69   3.529   5.789  16.137
  509    HE1  TYR  69           HE1      TYR  69   5.495   7.040  20.464
  510    HE2  TYR  69           HE2      TYR  69   2.143   6.905  17.832
  511    HH   TYR  69           HH       TYR  69   3.540   8.133  20.820
  512    H    ASP  70           HN       ASP  70   8.338   6.525  14.220
  513    HA   ASP  70           HA       ASP  70   7.987   9.191  15.232
  514   1HB   ASP  70          HB2       ASP  70  10.282   9.625  14.601
  515   2HB   ASP  70          HB1       ASP  70  10.176   8.080  15.427
  516    HA   PRO  71           HA       PRO  71   7.508  10.393  10.711
  517   1HB   PRO  71          HB2       PRO  71   7.148   8.308   8.879
  518   2HB   PRO  71          HB1       PRO  71   8.633   9.227   9.123
  519   1HG   PRO  71          HG2       PRO  71   8.219   6.489   9.679
  520   2HG   PRO  71          HG1       PRO  71   9.626   7.466  10.127
  521   1HD   PRO  71          HD2       PRO  71   7.276   6.670  11.761
  522   2HD   PRO  71          HD1       PRO  71   8.952   6.979  12.261
  523    HA   PRO  72           HA       PRO  72   3.122   9.694  11.485
  524   1HB   PRO  72          HB2       PRO  72   2.768  12.253  10.106
  525   2HB   PRO  72          HB1       PRO  72   2.416  11.827  11.783
  526   1HG   PRO  72          HG2       PRO  72   4.441  13.477  11.119
  527   2HG   PRO  72          HG1       PRO  72   4.532  12.377  12.507
  528   1HD   PRO  72          HD2       PRO  72   5.706  12.070   9.766
  529   2HD   PRO  72          HD1       PRO  72   6.436  11.723  11.350
  530    H    GLU  73           HN       GLU  73   4.388   8.558   9.125
  531    HA   GLU  73           HA       GLU  73   2.718   9.292   6.865
  532   1HB   GLU  73          HB2       GLU  73   4.737   7.058   7.085
  533   2HB   GLU  73          HB1       GLU  73   4.065   7.731   5.607
  534   1HG   GLU  73          HG2       GLU  73   5.187   9.841   6.038
  535   2HG   GLU  73          HG1       GLU  73   5.830   9.201   7.551
  536    H    GLY  74           HN       GLY  74   3.151   6.625   9.127
  537   1HA   GLY  74          HA2       GLY  74   1.572   5.066   9.808
  538   2HA   GLY  74          HA1       GLY  74   0.458   5.714   8.612
  539    H    TRP  75           HN       TRP  75   3.174   3.554   9.124
  540    HA   TRP  75           HA       TRP  75   2.182   1.845   7.015
  541   1HB   TRP  75          HB2       TRP  75   4.510   1.619   6.021
  542   2HB   TRP  75          HB1       TRP  75   3.653   3.109   5.652
  543    HD1  TRP  75           HD1      TRP  75   4.717   5.358   6.458
  544    HE1  TRP  75           HE1      TRP  75   6.980   5.981   7.515
  545    HE3  TRP  75           HE3      TRP  75   6.334   0.671   7.704
  546    HZ2  TRP  75           HZ2      TRP  75   9.161   4.648   8.726
  547    HZ3  TRP  75           HZ3      TRP  75   8.517   0.432   8.806
  548    HH2  TRP  75           HH2      TRP  75   9.901   2.377   9.308
  549    H    GLY  76           HN       GLY  76   2.585  -0.274   7.371
  550   1HA   GLY  76          HA2       GLY  76   4.100  -0.906   9.818
  551   2HA   GLY  76          HA1       GLY  76   2.817  -1.895   9.137
  552    H    TRP  77           HN       TRP  77   5.844  -2.170   9.787
  553    HA   TRP  77           HA       TRP  77   6.669  -3.336   7.217
  554   1HB   TRP  77          HB2       TRP  77   8.317  -1.837   8.210
  555   2HB   TRP  77          HB1       TRP  77   8.250  -2.721   9.729
  556    HD1  TRP  77           HD1      TRP  77   9.628  -4.986   9.898
  557    HE1  TRP  77           HE1      TRP  77  11.451  -6.046   8.413
  558    HE3  TRP  77           HE3      TRP  77   9.063  -2.077   5.737
  559    HZ2  TRP  77           HZ2      TRP  77  12.504  -5.681   5.824
  560    HZ3  TRP  77           HZ3      TRP  77  10.519  -2.494   3.797
  561    HH2  TRP  77           HH2      TRP  77  12.205  -4.259   3.842
  562    H    CYS  78           HN       CYS  78   6.903  -5.510   6.999
  563    HA   CYS  78           HA       CYS  78   6.246  -7.127   9.377
  564   1HB   CYS  78          HB2       CYS  78   4.706  -7.040   7.253
  565   2HB   CYS  78          HB1       CYS  78   5.904  -8.132   6.576
  566    H    TYR  79           HN       TYR  79   7.951  -8.162  10.166
  567    HA   TYR  79           HA       TYR  79  10.486  -8.144   9.058
  568   1HB   TYR  79          HB2       TYR  79   9.277  -9.933  11.154
  569   2HB   TYR  79          HB1       TYR  79  10.978 -10.014  10.716
  570    HD1  TYR  79           HD1      TYR  79  12.285  -7.754  10.854
  571    HD2  TYR  79           HD2      TYR  79   8.610  -8.512  12.855
  572    HE1  TYR  79           HE1      TYR  79  12.803  -5.974  12.465
  573    HE2  TYR  79           HE2      TYR  79   9.115  -6.729  14.469
  574    HH   TYR  79           HH       TYR  79  11.218  -5.613  15.365
  575    H    VAL  80           HN       VAL  80   8.543 -11.114   9.429
  576    HA   VAL  80           HA       VAL  80  10.303 -12.710   7.944
  577    HB   VAL  80           HB       VAL  80   8.426 -14.371   7.866
  578   1HG1  VAL  80          HG11      VAL  80   9.099 -13.102  10.517
  579   2HG1  VAL  80          HG12      VAL  80   9.992 -14.383   9.697
  580   3HG1  VAL  80          HG13      VAL  80   8.372 -14.697  10.321
  581   1HG2  VAL  80          HG21      VAL  80   6.945 -12.213   9.371
  582   2HG2  VAL  80          HG22      VAL  80   6.403 -13.878   9.167
  583   3HG2  VAL  80          HG23      VAL  80   6.548 -12.820   7.763
  584    H    ASP  81           HN       ASP  81   7.877 -10.556   6.868
  585    HA   ASP  81           HA       ASP  81   7.601 -11.813   4.256
  586   1HB   ASP  81          HB2       ASP  81   6.506  -9.169   5.239
  587   2HB   ASP  81          HB1       ASP  81   6.066  -9.983   3.746
  588    H    GLU  82           HN       GLU  82   9.106  -9.066   5.795
  589    HA   GLU  82           HA       GLU  82  10.688  -7.584   5.178
  590   1HB   GLU  82          HB2       GLU  82  11.084  -9.474   2.859
  591   2HB   GLU  82          HB1       GLU  82  12.095  -8.067   3.160
  592   1HG   GLU  82          HG2       GLU  82  12.653  -9.021   5.383
  593   2HG   GLU  82          HG1       GLU  82  11.761 -10.474   4.930
  594    H    VAL  83           HN       VAL  83   7.868  -7.479   4.260
  595    HA   VAL  83           HA       VAL  83   8.273  -5.509   2.116
  596    HB   VAL  83           HB       VAL  83   5.941  -5.834   1.426
  597   1HG1  VAL  83          HG11      VAL  83   7.682  -7.074   0.285
  598   2HG1  VAL  83          HG12      VAL  83   6.203  -8.030   0.374
  599   3HG1  VAL  83          HG13      VAL  83   7.549  -8.383   1.459
  600   1HG2  VAL  83          HG21      VAL  83   5.898  -8.085   3.441
  601   2HG2  VAL  83          HG22      VAL  83   4.639  -7.755   2.250
  602   3HG2  VAL  83          HG23      VAL  83   4.973  -6.586   3.528
  603    H    MET  84           HN       MET  84   7.480  -3.506   2.376
  604    HA   MET  84           HA       MET  84   6.237  -2.855   4.952
  605   1HB   MET  84          HB2       MET  84   8.237  -1.562   4.265
  606   2HB   MET  84          HB1       MET  84   7.396  -1.048   2.812
  607   1HG   MET  84          HG2       MET  84   5.768   0.150   4.153
  608   2HG   MET  84          HG1       MET  84   6.556  -0.402   5.630
  609   1HE   MET  84          HE1       MET  84   6.938   1.765   2.376
  610   2HE   MET  84          HE2       MET  84   8.349   0.710   2.299
  611   3HE   MET  84          HE3       MET  84   8.556   2.438   2.583
  612    H    PHE  85           HN       PHE  85   4.167  -2.058   5.065
  613    HA   PHE  85           HA       PHE  85   2.824  -1.496   2.515
  614   1HB   PHE  85          HB2       PHE  85   0.781  -2.620   3.341
  615   2HB   PHE  85          HB1       PHE  85   2.125  -3.735   3.149
  616    HD1  PHE  85           HD1      PHE  85  -0.025  -2.002   5.570
  617    HD2  PHE  85           HD2      PHE  85   3.081  -4.866   5.040
  618    HE1  PHE  85           HE1      PHE  85  -0.366  -2.795   7.874
  619    HE2  PHE  85           HE2      PHE  85   2.742  -5.657   7.346
  620    HZ   PHE  85           HZ       PHE  85   1.028  -4.617   8.768
  621    H    ASP  86           HN       ASP  86   1.274   0.112   2.572
  622    HA   ASP  86           HA       ASP  86   1.572   2.065   4.603
  623   1HB   ASP  86          HB2       ASP  86  -0.216   3.282   3.434
  624   2HB   ASP  86          HB1       ASP  86   1.002   2.702   2.305
  625    H    LEU  87           HN       LEU  87   0.289   2.565   6.302
  626    HA   LEU  87           HA       LEU  87  -1.996   0.821   6.861
  627   1HB   LEU  87          HB2       LEU  87   0.120  -0.187   7.757
  628   2HB   LEU  87          HB1       LEU  87   0.319   1.233   8.760
  629    HG   LEU  87           HG       LEU  87  -1.677   0.686  10.009
  630   1HD1  LEU  87          HD11      LEU  87  -3.007  -0.302   8.229
  631   2HD1  LEU  87          HD12      LEU  87  -2.897  -1.401   9.605
  632   3HD1  LEU  87          HD13      LEU  87  -1.918  -1.687   8.167
  633   1HD2  LEU  87          HD21      LEU  87   0.428  -0.299  10.731
  634   2HD2  LEU  87          HD22      LEU  87   0.143  -1.693   9.689
  635   3HD2  LEU  87          HD23      LEU  87  -0.921  -1.386  11.061
  636    H    SER  88           HN       SER  88  -1.549   3.657   6.184
  637    HA   SER  88           HA       SER  88  -1.569   5.327   8.436
  638   1HB   SER  88          HB2       SER  88  -1.010   6.066   6.137
  639   2HB   SER  88          HB1       SER  88  -2.703   5.881   5.685
  640    HG   SER  88           HG       SER  88  -2.827   7.889   6.303
  641    H    ASP  89           HN       ASP  89  -4.185   3.717   6.715
  642    HA   ASP  89           HA       ASP  89  -6.284   5.232   7.890
  643   1HB   ASP  89          HB2       ASP  89  -6.127   2.715   6.313
  644   2HB   ASP  89          HB1       ASP  89  -7.589   2.994   7.252
  645    H    ARG  90           HN       ARG  90  -4.301   2.733   9.109
  646    HA   ARG  90           HA       ARG  90  -6.110   2.434  11.419
  647   1HB   ARG  90          HB2       ARG  90  -4.387   0.235  10.259
  648   2HB   ARG  90          HB1       ARG  90  -5.495   0.095  11.615
  649   1HG   ARG  90          HG2       ARG  90  -7.382   0.496  10.134
  650   2HG   ARG  90          HG1       ARG  90  -6.280   0.675   8.768
  651   1HD   ARG  90          HD2       ARG  90  -5.472  -1.654   9.237
  652   2HD   ARG  90          HD1       ARG  90  -6.776  -1.799  10.415
  653    HE   ARG  90           HE       ARG  90  -7.996  -0.996   8.084
  654   1HH1  ARG  90          HH11      ARG  90  -6.076  -3.742   9.139
  655   2HH1  ARG  90          HH12      ARG  90  -6.716  -4.816   7.925
  656   1HH2  ARG  90          HH21      ARG  90  -8.850  -2.408   6.509
  657   2HH2  ARG  90          HH22      ARG  90  -8.305  -4.056   6.447
  658    H    MET  91           HN       MET  91  -3.581   4.037  10.740
  659    HA   MET  91           HA       MET  91  -1.403   2.812  12.081
  660   1HB   MET  91          HB2       MET  91  -0.225   4.902  11.796
  661   2HB   MET  91          HB1       MET  91  -1.107   4.527  10.323
  662   1HG   MET  91          HG2       MET  91  -2.789   6.143  10.844
  663   2HG   MET  91          HG1       MET  91  -2.089   6.425  12.436
  664   1HE   MET  91          HE1       MET  91   1.049   6.481  11.785
  665   2HE   MET  91          HE2       MET  91   0.206   7.596  12.860
  666   3HE   MET  91          HE3       MET  91   1.262   8.221  11.591
  667    H    THR  92           HN       THR  92  -0.234   3.858  13.909
  668    HA   THR  92           HA       THR  92  -2.084   4.109  16.111
  669    HB   THR  92           HB       THR  92  -0.002   4.133  17.493
  670    HG1  THR  92           HG1      THR  92   1.233   3.814  14.933
  671   1HG2  THR  92          HG21      THR  92  -0.262   1.863  15.525
  672   2HG2  THR  92          HG22      THR  92  -1.172   2.046  17.025
  673   3HG2  THR  92          HG23      THR  92   0.572   1.786  17.078
  674    HA   PRO  93           HA       PRO  93  -1.865   8.553  16.192
  675   1HB   PRO  93          HB2       PRO  93  -3.089   8.930  18.575
  676   2HB   PRO  93          HB1       PRO  93  -3.975   8.471  17.116
  677   1HG   PRO  93          HG2       PRO  93  -3.072   6.767  19.402
  678   2HG   PRO  93          HG1       PRO  93  -4.608   6.732  18.516
  679   1HD   PRO  93          HD2       PRO  93  -2.567   4.978  18.061
  680   2HD   PRO  93          HD1       PRO  93  -3.742   5.458  16.819
  681    H    HIS  94           HN       HIS  94   0.082   9.438  16.537
  682    HA   HIS  94           HA       HIS  94   1.851   8.713  18.590
  683   1HB   HIS  94          HB2       HIS  94   3.148  10.728  17.985
  684   2HB   HIS  94          HB1       HIS  94   2.703   9.768  16.586
  685    HD1  HIS  94           HD1      HIS  94   3.457  12.897  16.749
  686    HD2  HIS  94           HD2      HIS  94  -0.316  11.235  16.194
  687    HE1  HIS  94           HE1      HIS  94   2.094  14.667  15.593
  688    HE2  HIS  94           HE2      HIS  94  -0.238  13.729  15.517
  689    H    ASN  95           HN       ASN  95   1.525   8.919  20.651
  690    HA   ASN  95           HA       ASN  95  -0.590  10.691  21.549
  691   1HB   ASN  95          HB2       ASN  95  -0.625   9.335  23.548
  692   2HB   ASN  95          HB1       ASN  95  -0.567   8.284  22.138
  693   1HD2  ASN  95          HD21      ASN  95   0.120   7.504  24.742
  694   2HD2  ASN  95          HD22      ASN  95   1.805   7.101  24.751
  695    H    GLY  96           HN       GLY  96   2.627  11.184  21.253
  696   1HA   GLY  96          HA2       GLY  96   2.562  13.235  23.297
  697   2HA   GLY  96          HA1       GLY  96   3.739  11.961  23.576
  698    HA   PRO  97           HA       PRO  97   5.611  15.202  20.739
  699   1HB   PRO  97          HB2       PRO  97   7.330  16.329  22.491
  700   2HB   PRO  97          HB1       PRO  97   5.675  16.914  22.282
  701   1HG   PRO  97          HG2       PRO  97   6.808  15.150  24.414
  702   2HG   PRO  97          HG1       PRO  97   5.648  16.482  24.560
  703   1HD   PRO  97          HD2       PRO  97   4.928  13.847  24.540
  704   2HD   PRO  97          HD1       PRO  97   3.868  15.159  23.989
  705    H    ILE  98           HN       ILE  98   7.169  14.346  19.544
  706    HA   ILE  98           HA       ILE  98   9.148  12.601  20.863
  707    HB   ILE  98           HB       ILE  98   8.099  12.384  18.037
  708   1HG1  ILE  98          HG12      ILE  98   7.600  10.616  20.446
  709   2HG1  ILE  98          HG11      ILE  98   6.444  11.769  19.789
  710   1HG2  ILE  98          HG21      ILE  98   9.349  10.283  17.971
  711   2HG2  ILE  98          HG22      ILE  98   9.955  10.590  19.599
  712   3HG2  ILE  98          HG23      ILE  98  10.420  11.653  18.269
  713   1HD1  ILE  98          HD11      ILE  98   5.933   9.505  19.098
  714   2HD1  ILE  98          HD12      ILE  98   7.531   9.352  18.368
  715   3HD1  ILE  98          HD13      ILE  98   6.366  10.502  17.708
  716    HA   PRO  99           HA       PRO  99  11.839  15.879  19.426
  717   1HB   PRO  99          HB2       PRO  99  13.959  14.322  20.709
  718   2HB   PRO  99          HB1       PRO  99  13.360  15.935  21.104
  719   1HG   PRO  99          HG2       PRO  99  12.916  13.799  22.694
  720   2HG   PRO  99          HG1       PRO  99  11.756  15.132  22.543
  721   1HD   PRO  99          HD2       PRO  99  11.711  12.425  21.260
  722   2HD   PRO  99          HD1       PRO  99  10.378  13.359  21.974
  723    H    ARG 100           HN       ARG 100  12.547  15.942  17.412
  724    HA   ARG 100           HA       ARG 100  13.538  13.704  15.966
  725   1HB   ARG 100          HB2       ARG 100  12.506  15.457  14.722
  726   2HB   ARG 100          HB1       ARG 100  13.546  16.677  15.440
  727   1HG   ARG 100          HG2       ARG 100  14.273  16.337  13.210
  728   2HG   ARG 100          HG1       ARG 100  15.476  15.607  14.272
  729   1HD   ARG 100          HD2       ARG 100  15.177  14.045  12.562
  730   2HD   ARG 100          HD1       ARG 100  14.219  13.420  13.903
  731    HE   ARG 100           HE       ARG 100  12.331  14.714  12.620
  732   1HH1  ARG 100          HH11      ARG 100  14.968  12.853  11.251
  733   2HH1  ARG 100          HH12      ARG 100  14.053  12.331   9.863
  734   1HH2  ARG 100          HH21      ARG 100  11.139  14.089  10.764
  735   2HH2  ARG 100          HH22      ARG 100  11.884  13.076   9.563
  736    H    TYR 101           HN       TYR 101  15.368  12.754  16.700
  737    HA   TYR 101           HA       TYR 101  17.605  14.392  17.569
  738   1HB   TYR 101          HB2       TYR 101  17.278  11.393  17.427
  739   2HB   TYR 101          HB1       TYR 101  18.703  12.213  18.056
  740    HD1  TYR 101           HD1      TYR 101  18.347  13.804  20.054
  741    HD2  TYR 101           HD2      TYR 101  15.494  10.897  18.832
  742    HE1  TYR 101           HE1      TYR 101  17.317  13.884  22.286
  743    HE2  TYR 101           HE2      TYR 101  14.458  10.971  21.058
  744    HH   TYR 101           HH       TYR 101  15.251  13.382  23.380
  745    H    VAL 102           HN       VAL 102  16.727  12.308  14.883
  746    HA   VAL 102           HA       VAL 102  19.329  12.803  13.648
  747    HB   VAL 102           HB       VAL 102  18.510  11.125  11.913
  748   1HG1  VAL 102          HG11      VAL 102  18.817  10.201  14.770
  749   2HG1  VAL 102          HG12      VAL 102  20.134  10.588  13.664
  750   3HG1  VAL 102          HG13      VAL 102  19.076   9.218  13.329
  751   1HG2  VAL 102          HG21      VAL 102  16.119  11.249  12.431
  752   2HG2  VAL 102          HG22      VAL 102  16.430  10.597  14.040
  753   3HG2  VAL 102          HG23      VAL 102  16.728   9.604  12.612
  Start of MODEL    7
    1   1H    MET   1          HT1       MET   1   1.460   1.945  -0.390
    2   2H    MET   1          HT2       MET   1   2.577   2.460   0.776
    3   3H    MET   1          HT3       MET   1   1.780   0.982   0.964
    4    HA   MET   1           HA       MET   1   3.646   1.622  -1.231
    5   1HB   MET   1          HB2       MET   1   4.728   1.466   1.013
    6   2HB   MET   1          HB1       MET   1   4.090  -0.165   1.166
    7   1HG   MET   1          HG2       MET   1   6.411  -0.208   0.492
    8   2HG   MET   1          HG1       MET   1   5.381  -0.859  -0.783
    9   1HE   MET   1          HE1       MET   1   8.470   0.166  -1.048
   10   2HE   MET   1          HE2       MET   1   8.382   0.915  -2.642
   11   3HE   MET   1          HE3       MET   1   7.566  -0.620  -2.342
   12    H    THR   2           HN       THR   2   2.723  -1.312   0.565
   13    HA   THR   2           HA       THR   2   1.675  -2.403  -1.962
   14    HB   THR   2           HB       THR   2   2.035  -4.649  -0.989
   15    HG1  THR   2           HG1      THR   2   3.566  -3.439   1.063
   16   1HG2  THR   2          HG21      THR   2   4.494  -4.662  -1.102
   17   2HG2  THR   2          HG22      THR   2   4.499  -2.902  -0.991
   18   3HG2  THR   2          HG23      THR   2   3.782  -3.695  -2.393
   19    H    MET   3           HN       MET   3  -0.086  -4.143  -1.477
   20    HA   MET   3           HA       MET   3  -2.214  -2.845  -0.091
   21   1HB   MET   3          HB2       MET   3  -2.622  -4.239  -2.069
   22   2HB   MET   3          HB1       MET   3  -2.034  -5.653  -1.207
   23   1HG   MET   3          HG2       MET   3  -3.887  -5.457   0.375
   24   2HG   MET   3          HG1       MET   3  -4.478  -4.045  -0.500
   25   1HE   MET   3          HE1       MET   3  -3.741  -7.891  -0.695
   26   2HE   MET   3          HE2       MET   3  -2.879  -7.274  -2.105
   27   3HE   MET   3          HE3       MET   3  -4.307  -8.285  -2.318
   28    H    GLY   4           HN       GLY   4  -0.132  -5.619   0.578
   29   1HA   GLY   4          HA2       GLY   4   0.462  -5.540   3.073
   30   2HA   GLY   4          HA1       GLY   4  -1.269  -5.742   3.293
   31    H    CYS   5           HN       CYS   5  -0.961  -7.668   4.406
   32    HA   CYS   5           HA       CYS   5  -0.762  -9.984   2.710
   33   1HB   CYS   5          HB2       CYS   5   1.003 -11.088   3.932
   34   2HB   CYS   5          HB1       CYS   5   1.606  -9.541   3.350
   35    H    ARG   6           HN       ARG   6  -1.119 -12.027   4.170
   36    HA   ARG   6           HA       ARG   6  -3.574 -11.673   5.464
   37   1HB   ARG   6          HB2       ARG   6  -3.201 -14.039   6.300
   38   2HB   ARG   6          HB1       ARG   6  -3.155 -13.801   4.560
   39   1HG   ARG   6          HG2       ARG   6  -0.734 -13.868   4.586
   40   2HG   ARG   6          HG1       ARG   6  -0.740 -14.022   6.345
   41   1HD   ARG   6          HD2       ARG   6  -1.724 -16.171   6.246
   42   2HD   ARG   6          HD1       ARG   6  -2.128 -15.985   4.539
   43    HE   ARG   6           HE       ARG   6   0.364 -15.979   4.173
   44   1HH1  ARG   6          HH11      ARG   6  -1.080 -17.598   6.931
   45   2HH1  ARG   6          HH12      ARG   6   0.179 -18.795   7.045
   46   1HH2  ARG   6          HH21      ARG   6   1.998 -17.549   4.300
   47   2HH2  ARG   6          HH22      ARG   6   1.930 -18.772   5.545
   48    H    HIS   7           HN       HIS   7  -0.355 -11.469   6.755
   49    HA   HIS   7           HA       HIS   7  -0.976 -11.914   9.476
   50   1HB   HIS   7          HB2       HIS   7   1.246 -10.275   8.248
   51   2HB   HIS   7          HB1       HIS   7   1.141 -10.693   9.954
   52    HD2  HIS   7           HD2      HIS   7   0.887 -13.738  10.139
   53    HE1  HIS   7           HE1      HIS   7   3.749 -13.997   7.035
   54    HE2  HIS   7           HE2      HIS   7   2.386 -15.314   8.720
   55    H    VAL   8           HN       VAL   8  -1.416  -9.160   7.404
   56    HA   VAL   8           HA       VAL   8  -1.564  -7.140   9.390
   57    HB   VAL   8           HB       VAL   8  -3.080  -7.133   6.784
   58   1HG1  VAL   8          HG11      VAL   8  -1.975  -4.889   8.457
   59   2HG1  VAL   8          HG12      VAL   8  -3.672  -5.351   8.334
   60   3HG1  VAL   8          HG13      VAL   8  -2.827  -4.713   6.923
   61   1HG2  VAL   8          HG21      VAL   8  -1.139  -6.109   5.765
   62   2HG2  VAL   8          HG22      VAL   8  -0.772  -7.728   6.362
   63   3HG2  VAL   8          HG23      VAL   8  -0.237  -6.312   7.267
   64    H    ALA   9           HN       ALA   9  -3.760  -9.537   8.208
   65    HA   ALA   9           HA       ALA   9  -6.122  -8.366   9.208
   66   1HB   ALA   9          HB1       ALA   9  -6.191 -10.040   7.450
   67   2HB   ALA   9          HB2       ALA   9  -7.131 -10.581   8.842
   68   3HB   ALA   9          HB3       ALA   9  -5.525 -11.247   8.549
   69    H    GLY  10           HN       GLY  10  -3.495  -9.797  10.757
   70   1HA   GLY  10          HA2       GLY  10  -5.099 -10.724  13.034
   71   2HA   GLY  10          HA1       GLY  10  -3.417 -11.126  12.736
   72    H    ILE  11           HN       ILE  11  -3.246  -8.016  12.098
   73    HA   ILE  11           HA       ILE  11  -2.411  -7.392  14.810
   74    HB   ILE  11           HB       ILE  11  -1.457  -5.328  13.899
   75   1HG1  ILE  11          HG12      ILE  11  -2.413  -6.329  11.208
   76   2HG1  ILE  11          HG11      ILE  11  -3.137  -4.990  12.090
   77   1HG2  ILE  11          HG21      ILE  11   0.292  -6.369  12.543
   78   2HG2  ILE  11          HG22      ILE  11  -0.720  -7.798  12.336
   79   3HG2  ILE  11          HG23      ILE  11  -0.126  -7.363  13.939
   80   1HD1  ILE  11          HD11      ILE  11  -0.322  -5.102  11.032
   81   2HD1  ILE  11          HD12      ILE  11  -1.026  -3.761  11.936
   82   3HD1  ILE  11          HD13      ILE  11  -1.664  -4.186  10.347
   83    H    ARG  12           HN       ARG  12  -3.033  -5.462  15.895
   84    HA   ARG  12           HA       ARG  12  -5.791  -4.653  15.243
   85   1HB   ARG  12          HB2       ARG  12  -6.181  -4.614  17.717
   86   2HB   ARG  12          HB1       ARG  12  -5.881  -6.221  17.063
   87   1HG   ARG  12          HG2       ARG  12  -3.500  -5.980  17.768
   88   2HG   ARG  12          HG1       ARG  12  -3.953  -4.480  18.578
   89   1HD   ARG  12          HD2       ARG  12  -5.268  -7.124  19.136
   90   2HD   ARG  12          HD1       ARG  12  -3.865  -6.540  20.025
   91    HE   ARG  12           HE       ARG  12  -5.964  -4.616  20.033
   92   1HH1  ARG  12          HH11      ARG  12  -4.924  -7.633  21.445
   93   2HH1  ARG  12          HH12      ARG  12  -5.798  -7.407  22.933
   94   1HH2  ARG  12          HH21      ARG  12  -7.102  -4.271  22.013
   95   2HH2  ARG  12          HH22      ARG  12  -7.046  -5.496  23.248
   96    H    THR  13           HN       THR  13  -6.412  -2.700  16.694
   97    HA   THR  13           HA       THR  13  -4.540  -0.574  16.255
   98    HB   THR  13           HB       THR  13  -6.966  -0.317  18.002
   99    HG1  THR  13           HG1      THR  13  -7.192  -0.150  15.182
  100   1HG2  THR  13          HG21      THR  13  -5.538   1.642  17.642
  101   2HG2  THR  13          HG22      THR  13  -7.123   1.869  16.903
  102   3HG2  THR  13          HG23      THR  13  -5.730   1.467  15.898
  103    H    VAL  14           HN       VAL  14  -2.779  -0.556  17.531
  104    HA   VAL  14           HA       VAL  14  -3.050  -1.570  20.264
  105    HB   VAL  14           HB       VAL  14  -0.557  -1.780  20.185
  106   1HG1  VAL  14          HG11      VAL  14  -2.048  -3.667  19.734
  107   2HG1  VAL  14          HG12      VAL  14  -0.565  -3.763  18.786
  108   3HG1  VAL  14          HG13      VAL  14  -2.065  -3.237  18.023
  109   1HG2  VAL  14          HG21      VAL  14  -0.940  -1.113  17.266
  110   2HG2  VAL  14          HG22      VAL  14   0.557  -1.670  18.016
  111   3HG2  VAL  14          HG23      VAL  14  -0.118  -0.101  18.454
  112    H    THR  15           HN       THR  15  -2.302  -0.484  22.029
  113    HA   THR  15           HA       THR  15  -2.212   2.398  21.787
  114    HB   THR  15           HB       THR  15  -1.953   0.764  24.317
  115    HG1  THR  15           HG1      THR  15  -4.167   1.217  22.661
  116   1HG2  THR  15          HG21      THR  15  -3.030   3.537  23.788
  117   2HG2  THR  15          HG22      THR  15  -1.474   3.157  24.525
  118   3HG2  THR  15          HG23      THR  15  -2.971   2.738  25.358
  119    HA   PRO  16           HA       PRO  16   2.249   2.472  21.661
  120   1HB   PRO  16          HB2       PRO  16   2.540   5.128  22.317
  121   2HB   PRO  16          HB1       PRO  16   2.178   4.535  20.694
  122   1HG   PRO  16          HG2       PRO  16   0.338   5.658  22.759
  123   2HG   PRO  16          HG1       PRO  16   0.339   5.904  21.003
  124   1HD   PRO  16          HD2       PRO  16  -1.390   4.234  22.226
  125   2HD   PRO  16          HD1       PRO  16  -0.755   3.914  20.598
  126    H    SER  17           HN       SER  17   3.689   1.929  23.136
  127    HA   SER  17           HA       SER  17   3.138   1.727  25.863
  128   1HB   SER  17          HB2       SER  17   5.918   1.850  24.691
  129   2HB   SER  17          HB1       SER  17   5.371   0.941  26.100
  130    HG   SER  17           HG       SER  17   3.874   0.055  24.206
  131    H    ALA  18           HN       ALA  18   5.101   4.097  24.095
  132    HA   ALA  18           HA       ALA  18   4.761   6.042  26.207
  133   1HB   ALA  18          HB1       ALA  18   7.511   5.037  25.456
  134   2HB   ALA  18          HB2       ALA  18   6.703   4.782  27.003
  135   3HB   ALA  18          HB3       ALA  18   7.172   6.410  26.510
  136    H    LEU  19           HN       LEU  19   6.134   8.087  25.532
  137    HA   LEU  19           HA       LEU  19   5.287   9.002  23.030
  138   1HB   LEU  19          HB2       LEU  19   7.645   9.938  24.674
  139   2HB   LEU  19          HB1       LEU  19   6.937  10.825  23.339
  140    HG   LEU  19           HG       LEU  19   5.534  10.158  25.927
  141   1HD1  LEU  19          HD11      LEU  19   6.663  12.760  24.905
  142   2HD1  LEU  19          HD12      LEU  19   7.307  11.798  26.235
  143   3HD1  LEU  19          HD13      LEU  19   5.721  12.554  26.381
  144   1HD2  LEU  19          HD21      LEU  19   3.997  10.288  24.042
  145   2HD2  LEU  19          HD22      LEU  19   4.672  11.853  23.587
  146   3HD2  LEU  19          HD23      LEU  19   3.800  11.677  25.111
  147    H    GLY  20           HN       GLY  20   8.598   8.152  23.998
  148   1HA   GLY  20          HA2       GLY  20   9.207   7.572  21.178
  149   2HA   GLY  20          HA1       GLY  20  10.401   7.982  22.405
  150    H    CYS  21           HN       CYS  21  11.626   6.106  22.017
  151    HA   CYS  21           HA       CYS  21  10.423   3.520  22.259
  152   1HB   CYS  21          HB2       CYS  21  12.490   3.906  20.935
  153   2HB   CYS  21          HB1       CYS  21  13.350   4.262  22.430
  154    HG   CYS  21           HG       CYS  21  11.913   1.385  22.874
  155    H    GLU  22           HN       GLU  22   9.813   2.625  24.030
  156    HA   GLU  22           HA       GLU  22   9.613   3.634  26.491
  157   1HB   GLU  22          HB2       GLU  22   8.475   1.639  25.885
  158   2HB   GLU  22          HB1       GLU  22   9.982   0.767  25.659
  159   1HG   GLU  22          HG2       GLU  22  10.263   1.365  28.228
  160   2HG   GLU  22          HG1       GLU  22   8.499   1.392  28.138
  161    H    GLU  23           HN       GLU  23  12.116   1.113  25.953
  162    HA   GLU  23           HA       GLU  23  13.289   1.671  28.475
  163   1HB   GLU  23          HB2       GLU  23  13.436  -0.553  27.589
  164   2HB   GLU  23          HB1       GLU  23  14.276   0.020  26.153
  165   1HG   GLU  23          HG2       GLU  23  16.230   0.531  27.389
  166   2HG   GLU  23          HG1       GLU  23  15.397   0.306  28.925
  167    H    CYS  24           HN       CYS  24  13.983   2.812  25.242
  168    HA   CYS  24           HA       CYS  24  16.591   3.740  25.729
  169   1HB   CYS  24          HB2       CYS  24  14.497   4.681  23.770
  170   2HB   CYS  24          HB1       CYS  24  16.155   5.273  23.787
  171    HG   CYS  24           HG       CYS  24  16.554   3.561  21.863
  172    H    LEU  25           HN       LEU  25  13.442   5.120  26.410
  173    HA   LEU  25           HA       LEU  25  14.225   7.769  26.917
  174   1HB   LEU  25          HB2       LEU  25  11.974   6.129  28.069
  175   2HB   LEU  25          HB1       LEU  25  12.159   7.850  28.342
  176    HG   LEU  25           HG       LEU  25  11.823   6.604  25.617
  177   1HD1  LEU  25          HD11      LEU  25   9.825   6.257  26.981
  178   2HD1  LEU  25          HD12      LEU  25   9.533   7.441  25.707
  179   3HD1  LEU  25          HD13      LEU  25   9.788   7.978  27.368
  180   1HD2  LEU  25          HD21      LEU  25  11.354   8.902  24.925
  181   2HD2  LEU  25          HD22      LEU  25  12.976   8.749  25.600
  182   3HD2  LEU  25          HD23      LEU  25  11.682   9.463  26.565
  183    H    LYS  26           HN       LYS  26  14.533   4.882  28.844
  184    HA   LYS  26           HA       LYS  26  14.636   6.132  31.384
  185   1HB   LYS  26          HB2       LYS  26  15.022   4.030  32.257
  186   2HB   LYS  26          HB1       LYS  26  14.263   3.619  30.729
  187   1HG   LYS  26          HG2       LYS  26  16.619   3.383  29.799
  188   2HG   LYS  26          HG1       LYS  26  17.163   3.444  31.476
  189   1HD   LYS  26          HD2       LYS  26  15.566   1.539  31.933
  190   2HD   LYS  26          HD1       LYS  26  15.362   1.408  30.184
  191   1HE   LYS  26          HE2       LYS  26  17.753   1.018  29.923
  192   2HE   LYS  26          HE1       LYS  26  17.980   1.175  31.663
  193   1HZ   LYS  26          HZ1       LYS  26  16.471  -0.957  30.239
  194   2HZ   LYS  26          HZ2       LYS  26  16.456  -0.752  31.923
  195   3HZ   LYS  26          HZ3       LYS  26  17.905  -1.129  31.129
  196    H    ILE  27           HN       ILE  27  16.969   5.773  28.869
  197    HA   ILE  27           HA       ILE  27  19.054   6.808  30.676
  198    HB   ILE  27           HB       ILE  27  20.733   5.573  29.277
  199   1HG1  ILE  27          HG12      ILE  27  18.286   4.052  28.345
  200   2HG1  ILE  27          HG11      ILE  27  19.245   5.141  27.348
  201   1HG2  ILE  27          HG21      ILE  27  20.146   4.809  31.499
  202   2HG2  ILE  27          HG22      ILE  27  20.405   3.429  30.431
  203   3HG2  ILE  27          HG23      ILE  27  18.766   3.922  30.852
  204   1HD1  ILE  27          HD11      ILE  27  20.198   2.574  28.595
  205   2HD1  ILE  27          HD12      ILE  27  21.178   3.667  27.617
  206   3HD1  ILE  27          HD13      ILE  27  19.802   2.832  26.896
  207    H    GLY  28           HN       GLY  28  17.154   7.658  28.217
  208   1HA   GLY  28          HA2       GLY  28  17.287   9.223  26.535
  209   2HA   GLY  28          HA1       GLY  28  18.794   9.755  27.272
  210    H    SER  29           HN       SER  29  17.870   6.672  25.813
  211    HA   SER  29           HA       SER  29  20.378   6.505  24.406
  212   1HB   SER  29          HB2       SER  29  19.333   4.519  25.445
  213   2HB   SER  29          HB1       SER  29  17.958   4.677  24.357
  214    HG   SER  29           HG       SER  29  20.509   4.511  23.225
  215    HA   PRO  30           HA       PRO  30  18.721   8.841  20.968
  216   1HB   PRO  30          HB2       PRO  30  21.253   8.000  19.690
  217   2HB   PRO  30          HB1       PRO  30  20.614   9.624  19.964
  218   1HG   PRO  30          HG2       PRO  30  22.662   8.690  21.401
  219   2HG   PRO  30          HG1       PRO  30  21.415   9.717  22.133
  220   1HD   PRO  30          HD2       PRO  30  21.755   6.746  22.296
  221   2HD   PRO  30          HD1       PRO  30  21.302   7.900  23.569
  222    H    TRP  31           HN       TRP  31  17.235   8.000  19.676
  223    HA   TRP  31           HA       TRP  31  17.867   5.523  18.231
  224   1HB   TRP  31          HB2       TRP  31  15.401   5.298  17.915
  225   2HB   TRP  31          HB1       TRP  31  15.911   5.217  19.595
  226    HD1  TRP  31           HD1      TRP  31  14.335   7.797  17.147
  227    HE1  TRP  31           HE1      TRP  31  12.801   9.339  18.522
  228    HE3  TRP  31           HE3      TRP  31  15.312   5.966  21.820
  229    HZ2  TRP  31           HZ2      TRP  31  12.087   9.715  21.224
  230    HZ3  TRP  31           HZ3      TRP  31  14.155   6.969  23.745
  231    HH2  TRP  31           HH2      TRP  31  12.577   8.806  23.450
  232    H    VAL  32           HN       VAL  32  17.154   5.356  16.031
  233    HA   VAL  32           HA       VAL  32  17.406   7.881  14.594
  234    HB   VAL  32           HB       VAL  32  17.265   5.047  13.540
  235   1HG1  VAL  32          HG11      VAL  32  17.999   7.616  12.139
  236   2HG1  VAL  32          HG12      VAL  32  16.539   6.662  11.873
  237   3HG1  VAL  32          HG13      VAL  32  18.116   5.998  11.444
  238   1HG2  VAL  32          HG21      VAL  32  19.257   5.404  14.892
  239   2HG2  VAL  32          HG22      VAL  32  19.649   6.847  13.956
  240   3HG2  VAL  32          HG23      VAL  32  19.678   5.261  13.186
  241    H    HIS  33           HN       HIS  33  15.284   5.021  14.442
  242    HA   HIS  33           HA       HIS  33  13.012   6.817  14.039
  243   1HB   HIS  33          HB2       HIS  33  13.768   4.491  12.281
  244   2HB   HIS  33          HB1       HIS  33  12.105   5.056  12.391
  245    HD1  HIS  33           HD1      HIS  33  14.851   5.396  10.252
  246    HD2  HIS  33           HD2      HIS  33  12.196   8.117  11.935
  247    HE1  HIS  33           HE1      HIS  33  14.979   7.449   8.810
  248    HE2  HIS  33           HE2      HIS  33  13.540   9.152   9.985
  249    H    LEU  34           HN       LEU  34  11.002   5.974  14.655
  250    HA   LEU  34           HA       LEU  34  11.237   3.808  16.646
  251   1HB   LEU  34          HB2       LEU  34   9.338   6.148  16.507
  252   2HB   LEU  34          HB1       LEU  34   9.230   4.857  17.689
  253    HG   LEU  34           HG       LEU  34  11.557   6.757  17.410
  254   1HD1  LEU  34          HD11      LEU  34  10.733   7.733  19.484
  255   2HD1  LEU  34          HD12      LEU  34   9.346   6.643  19.455
  256   3HD1  LEU  34          HD13      LEU  34   9.531   7.869  18.201
  257   1HD2  LEU  34          HD21      LEU  34  12.212   4.575  18.266
  258   2HD2  LEU  34          HD22      LEU  34  10.926   4.647  19.471
  259   3HD2  LEU  34          HD23      LEU  34  12.269   5.788  19.544
  260    H    ARG  35           HN       ARG  35   9.999   2.059  16.433
  261    HA   ARG  35           HA       ARG  35   7.773   2.184  14.530
  262   1HB   ARG  35          HB2       ARG  35   9.806  -0.050  14.723
  263   2HB   ARG  35          HB1       ARG  35   8.370  -0.063  13.705
  264   1HG   ARG  35          HG2       ARG  35   9.234   1.886  12.482
  265   2HG   ARG  35          HG1       ARG  35  10.683   1.860  13.487
  266   1HD   ARG  35          HD2       ARG  35  11.156  -0.426  12.656
  267   2HD   ARG  35          HD1       ARG  35   9.764  -0.290  11.583
  268    HE   ARG  35           HE       ARG  35  11.745   1.806  11.313
  269   1HH1  ARG  35          HH11      ARG  35  10.640  -1.318  10.159
  270   2HH1  ARG  35          HH12      ARG  35  11.469  -1.183   8.637
  271   1HH2  ARG  35          HH21      ARG  35  12.847   1.964   9.312
  272   2HH2  ARG  35          HH22      ARG  35  12.704   0.664   8.158
  273    H    ILE  36           HN       ILE  36   5.941   1.435  15.296
  274    HA   ILE  36           HA       ILE  36   5.980   0.276  17.991
  275    HB   ILE  36           HB       ILE  36   4.635   2.278  17.798
  276   1HG1  ILE  36          HG12      ILE  36   2.849  -0.157  17.981
  277   2HG1  ILE  36          HG11      ILE  36   3.867   0.446  19.284
  278   1HG2  ILE  36          HG21      ILE  36   2.606   2.322  16.367
  279   2HG2  ILE  36          HG22      ILE  36   3.160   0.831  15.604
  280   3HG2  ILE  36          HG23      ILE  36   4.119   2.305  15.460
  281   1HD1  ILE  36          HD11      ILE  36   1.579   1.928  18.011
  282   2HD1  ILE  36          HD12      ILE  36   2.588   2.516  19.332
  283   3HD1  ILE  36          HD13      ILE  36   1.549   1.111  19.574
  284    H    CYS  37           HN       CYS  37   5.570  -1.709  18.327
  285    HA   CYS  37           HA       CYS  37   5.081  -3.569  16.251
  286   1HB   CYS  37          HB2       CYS  37   6.369  -4.063  18.264
  287   2HB   CYS  37          HB1       CYS  37   4.938  -3.826  19.251
  288    H    ARG  38           HN       ARG  38   3.164  -3.677  15.238
  289    HA   ARG  38           HA       ARG  38   0.756  -2.664  16.372
  290   1HB   ARG  38          HB2       ARG  38   1.321  -4.181  13.832
  291   2HB   ARG  38          HB1       ARG  38  -0.279  -3.600  14.264
  292   1HG   ARG  38          HG2       ARG  38   2.127  -1.819  13.982
  293   2HG   ARG  38          HG1       ARG  38   0.976  -2.140  12.685
  294   1HD   ARG  38          HD2       ARG  38   0.350  -0.882  15.357
  295   2HD   ARG  38          HD1       ARG  38   0.456  -0.043  13.810
  296    HE   ARG  38           HE       ARG  38  -1.559  -2.142  14.295
  297   1HH1  ARG  38          HH11      ARG  38  -0.688   1.097  13.273
  298   2HH1  ARG  38          HH12      ARG  38  -2.293   1.479  12.719
  299   1HH2  ARG  38          HH21      ARG  38  -3.674  -1.625  13.556
  300   2HH2  ARG  38          HH22      ARG  38  -3.976  -0.045  12.904
  301    H    THR  39           HN       THR  39   2.198  -5.412  17.214
  302    HA   THR  39           HA       THR  39  -0.226  -7.049  17.193
  303    HB   THR  39           HB       THR  39   2.463  -7.957  18.192
  304    HG1  THR  39           HG1      THR  39   1.558  -8.174  15.498
  305   1HG2  THR  39          HG21      THR  39   0.560  -9.413  18.639
  306   2HG2  THR  39          HG22      THR  39   1.636 -10.150  17.451
  307   3HG2  THR  39          HG23      THR  39   0.130  -9.398  16.928
  308    H    CYS  40           HN       CYS  40   1.851  -5.273  19.360
  309    HA   CYS  40           HA       CYS  40   0.083  -5.986  21.573
  310   1HB   CYS  40          HB2       CYS  40   1.876  -6.598  23.061
  311   2HB   CYS  40          HB1       CYS  40   2.036  -7.552  21.594
  312    H    GLY  41           HN       GLY  41   1.608  -3.609  19.853
  313   1HA   GLY  41          HA2       GLY  41   1.409  -1.334  20.183
  314   2HA   GLY  41          HA1       GLY  41   0.799  -1.651  21.797
  315    H    HIS  42           HN       HIS  42   3.786  -3.187  21.104
  316    HA   HIS  42           HA       HIS  42   5.046  -1.450  23.047
  317   1HB   HIS  42          HB2       HIS  42   5.297  -4.087  22.690
  318   2HB   HIS  42          HB1       HIS  42   6.621  -3.558  21.657
  319    HD1  HIS  42           HD1      HIS  42   5.779  -4.258  25.109
  320    HD2  HIS  42           HD2      HIS  42   8.567  -1.886  23.131
  321    HE1  HIS  42           HE1      HIS  42   7.540  -3.711  26.817
  322    HE2  HIS  42           HE2      HIS  42   9.107  -2.116  25.660
  323    H    VAL  43           HN       VAL  43   6.011   0.347  22.486
  324    HA   VAL  43           HA       VAL  43   6.842   0.804  19.740
  325    HB   VAL  43           HB       VAL  43   6.999   2.662  22.124
  326   1HG1  VAL  43          HG11      VAL  43   7.293   3.192  19.169
  327   2HG1  VAL  43          HG12      VAL  43   8.558   3.310  20.393
  328   3HG1  VAL  43          HG13      VAL  43   7.199   4.434  20.417
  329   1HG2  VAL  43          HG21      VAL  43   5.001   3.729  21.196
  330   2HG2  VAL  43          HG22      VAL  43   4.695   2.048  21.631
  331   3HG2  VAL  43          HG23      VAL  43   4.926   2.492  19.941
  332    H    GLY  44           HN       GLY  44   8.852   0.525  19.026
  333   1HA   GLY  44          HA2       GLY  44  11.073   0.755  20.927
  334   2HA   GLY  44          HA1       GLY  44  10.908  -0.732  20.004
  335    H    CYS  45           HN       CYS  45  13.094   1.163  19.985
  336    HA   CYS  45           HA       CYS  45  13.024   2.575  17.507
  337   1HB   CYS  45          HB2       CYS  45  15.447   2.850  17.858
  338   2HB   CYS  45          HB1       CYS  45  14.539   3.250  19.311
  339    HG   CYS  45           HG       CYS  45  16.625   0.641  18.741
  340    H    CYS  46           HN       CYS  46  13.825   1.962  15.519
  341    HA   CYS  46           HA       CYS  46  13.702  -0.832  14.955
  342   1HB   CYS  46          HB2       CYS  46  14.253  -0.105  12.625
  343   2HB   CYS  46          HB1       CYS  46  12.864   0.720  13.325
  344    HG   CYS  46           HG       CYS  46  15.232   2.098  11.788
  345    H    ASP  47           HN       ASP  47  15.525  -1.570  13.225
  346    HA   ASP  47           HA       ASP  47  17.831  -1.947  14.881
  347   1HB   ASP  47          HB2       ASP  47  18.594  -3.489  13.187
  348   2HB   ASP  47          HB1       ASP  47  16.877  -3.754  13.467
  349    H    ASP  48           HN       ASP  48  16.941   0.382  12.629
  350    HA   ASP  48           HA       ASP  48  19.455   1.178  11.629
  351   1HB   ASP  48          HB2       ASP  48  17.065   2.893  12.357
  352   2HB   ASP  48          HB1       ASP  48  18.441   3.430  11.401
  353    H    SER  49           HN       SER  49  17.947   1.399  14.715
  354    HA   SER  49           HA       SER  49  19.917   3.310  15.728
  355   1HB   SER  49          HB2       SER  49  17.657   2.029  17.270
  356   2HB   SER  49          HB1       SER  49  18.504   3.536  17.628
  357    HG   SER  49           HG       SER  49  17.154   3.276  15.187
  358    HA   PRO  50           HA       PRO  50  22.679   0.203  17.097
  359   1HB   PRO  50          HB2       PRO  50  23.482   1.362  19.496
  360   2HB   PRO  50          HB1       PRO  50  24.166   1.708  17.906
  361   1HG   PRO  50          HG2       PRO  50  22.110   3.216  19.457
  362   2HG   PRO  50          HG1       PRO  50  23.433   3.833  18.450
  363   1HD   PRO  50          HD2       PRO  50  20.912   3.824  17.562
  364   2HD   PRO  50          HD1       PRO  50  22.267   3.457  16.473
  365    H    HIS  51           HN       HIS  51  20.215   1.302  19.357
  366    HA   HIS  51           HA       HIS  51  20.645  -0.775  21.271
  367   1HB   HIS  51          HB2       HIS  51  19.355   1.582  21.388
  368   2HB   HIS  51          HB1       HIS  51  17.981   0.529  21.091
  369    HD1  HIS  51           HD1      HIS  51  18.839   2.151  23.797
  370    HD2  HIS  51           HD2      HIS  51  19.009  -1.946  23.096
  371    HE1  HIS  51           HE1      HIS  51  18.638   1.066  26.064
  372    HE2  HIS  51           HE2      HIS  51  18.996  -1.398  25.628
  373    H    LYS  52           HN       LYS  52  18.869  -0.493  18.333
  374    HA   LYS  52           HA       LYS  52  17.331  -1.792  17.247
  375   1HB   LYS  52          HB2       LYS  52  19.244  -3.915  18.224
  376   2HB   LYS  52          HB1       LYS  52  18.147  -4.069  16.861
  377   1HG   LYS  52          HG2       LYS  52  19.330  -2.198  15.754
  378   2HG   LYS  52          HG1       LYS  52  20.476  -2.178  17.093
  379   1HD   LYS  52          HD2       LYS  52  19.950  -4.580  15.352
  380   2HD   LYS  52          HD1       LYS  52  21.256  -3.426  15.079
  381   1HE   LYS  52          HE2       LYS  52  22.145  -3.938  17.316
  382   2HE   LYS  52          HE1       LYS  52  20.861  -5.127  17.538
  383   1HZ   LYS  52          HZ1       LYS  52  21.722  -6.402  15.714
  384   2HZ   LYS  52          HZ2       LYS  52  22.979  -6.111  16.813
  385   3HZ   LYS  52          HZ3       LYS  52  22.890  -5.223  15.370
  386    H    HIS  53           HN       HIS  53  15.799  -1.271  19.204
  387    HA   HIS  53           HA       HIS  53  15.198  -3.507  20.900
  388   1HB   HIS  53          HB2       HIS  53  14.051  -0.789  20.507
  389   2HB   HIS  53          HB1       HIS  53  13.028  -2.014  21.252
  390    HD1  HIS  53           HD1      HIS  53  14.641   0.639  22.469
  391    HD2  HIS  53           HD2      HIS  53  15.220  -3.405  23.220
  392    HE1  HIS  53           HE1      HIS  53  15.747   0.522  24.719
  393    HE2  HIS  53           HE2      HIS  53  15.877  -1.938  25.254
  394    H    ALA  54           HN       ALA  54  13.807  -2.156  17.952
  395    HA   ALA  54           HA       ALA  54  11.382  -3.554  17.988
  396   1HB   ALA  54          HB1       ALA  54  11.877  -1.625  16.530
  397   2HB   ALA  54          HB2       ALA  54  11.186  -2.991  15.654
  398   3HB   ALA  54          HB3       ALA  54  12.916  -2.662  15.552
  399    H    THR  55           HN       THR  55  14.536  -4.484  16.701
  400    HA   THR  55           HA       THR  55  13.564  -6.825  15.385
  401    HB   THR  55           HB       THR  55  16.062  -7.370  15.273
  402    HG1  THR  55           HG1      THR  55  17.457  -5.764  15.907
  403   1HG2  THR  55          HG21      THR  55  14.847  -6.356  13.417
  404   2HG2  THR  55          HG22      THR  55  16.461  -5.659  13.554
  405   3HG2  THR  55          HG23      THR  55  15.060  -4.759  14.135
  406    H    ARG  56           HN       ARG  56  15.429  -6.251  18.361
  407    HA   ARG  56           HA       ARG  56  15.671  -8.963  19.086
  408   1HB   ARG  56          HB2       ARG  56  15.686  -6.523  20.876
  409   2HB   ARG  56          HB1       ARG  56  16.267  -8.123  21.321
  410   1HG   ARG  56          HG2       ARG  56  18.011  -7.986  19.642
  411   2HG   ARG  56          HG1       ARG  56  17.402  -6.417  19.114
  412   1HD   ARG  56          HD2       ARG  56  19.232  -5.936  20.507
  413   2HD   ARG  56          HD1       ARG  56  17.804  -5.624  21.491
  414    HE   ARG  56           HE       ARG  56  18.697  -8.284  21.884
  415   1HH1  ARG  56          HH11      ARG  56  19.473  -4.965  22.708
  416   2HH1  ARG  56          HH12      ARG  56  20.358  -5.399  24.137
  417   1HH2  ARG  56          HH21      ARG  56  19.881  -8.840  23.755
  418   2HH2  ARG  56          HH22      ARG  56  20.584  -7.583  24.732
  419    H    HIS  57           HN       HIS  57  13.130  -6.621  19.511
  420    HA   HIS  57           HA       HIS  57  11.607  -8.058  21.417
  421   1HB   HIS  57          HB2       HIS  57  11.174  -5.702  21.019
  422   2HB   HIS  57          HB1       HIS  57  10.754  -6.029  19.341
  423    HD1  HIS  57           HD1      HIS  57   9.408  -6.431  22.850
  424    HD2  HIS  57           HD2      HIS  57   8.193  -6.918  18.895
  425    HE1  HIS  57           HE1      HIS  57   6.909  -6.846  22.907
  426    H    PHE  58           HN       PHE  58  11.534  -7.967  17.860
  427    HA   PHE  58           HA       PHE  58   9.386  -9.739  17.495
  428   1HB   PHE  58          HB2       PHE  58  10.149  -8.481  15.609
  429   2HB   PHE  58          HB1       PHE  58  11.781  -9.121  15.760
  430    HD1  PHE  58           HD1      PHE  58   8.392 -10.699  15.598
  431    HD2  PHE  58           HD2      PHE  58  12.307 -10.438  13.982
  432    HE1  PHE  58           HE1      PHE  58   7.850 -12.495  14.007
  433    HE2  PHE  58           HE2      PHE  58  11.782 -12.232  12.386
  434    HZ   PHE  58           HZ       PHE  58   9.547 -13.267  12.399
  435    H    HIS  59           HN       HIS  59  12.849 -10.296  17.823
  436    HA   HIS  59           HA       HIS  59  12.862 -13.063  17.395
  437   1HB   HIS  59          HB2       HIS  59  14.885 -11.659  17.413
  438   2HB   HIS  59          HB1       HIS  59  14.692 -11.398  19.142
  439    HD1  HIS  59           HD1      HIS  59  15.719 -13.090  20.674
  440    HD2  HIS  59           HD2      HIS  59  15.564 -14.389  16.724
  441    HE1  HIS  59           HE1      HIS  59  17.043 -15.233  20.608
  442    HE2  HIS  59           HE2      HIS  59  16.747 -16.104  18.257
  443    H    ALA  60           HN       ALA  60  11.883 -11.197  20.152
  444    HA   ALA  60           HA       ALA  60  12.041 -13.487  21.945
  445   1HB   ALA  60          HB1       ALA  60  12.814 -11.311  22.742
  446   2HB   ALA  60          HB2       ALA  60  11.466 -11.915  23.707
  447   3HB   ALA  60          HB3       ALA  60  11.196 -10.650  22.507
  448    H    THR  61           HN       THR  61   9.543 -11.270  20.683
  449    HA   THR  61           HA       THR  61   7.492 -12.841  22.046
  450    HB   THR  61           HB       THR  61   5.943 -11.035  21.125
  451    HG1  THR  61           HG1      THR  61   8.469  -9.814  20.583
  452   1HG2  THR  61          HG21      THR  61   6.736 -11.094  23.458
  453   2HG2  THR  61          HG22      THR  61   6.539  -9.446  22.861
  454   3HG2  THR  61          HG23      THR  61   8.153 -10.154  22.987
  455    H    GLY  62           HN       GLY  62   8.817 -12.518  18.892
  456   1HA   GLY  62          HA2       GLY  62   8.250 -13.552  16.911
  457   2HA   GLY  62          HA1       GLY  62   7.021 -14.449  17.795
  458    H    HIS  63           HN       HIS  63   7.364 -10.950  17.467
  459    HA   HIS  63           HA       HIS  63   4.674 -10.884  16.271
  460   1HB   HIS  63          HB2       HIS  63   6.155  -8.807  17.897
  461   2HB   HIS  63          HB1       HIS  63   4.630  -8.500  17.077
  462    HD2  HIS  63           HD2      HIS  63   3.722 -11.737  18.252
  463    HE1  HIS  63           HE1      HIS  63   3.342  -9.318  21.712
  464    HE2  HIS  63           HE2      HIS  63   2.834 -11.597  20.693
  465    HA   PRO  64           HA       PRO  64   7.407  -9.867  12.898
  466   1HB   PRO  64          HB2       PRO  64   5.905 -10.802  10.910
  467   2HB   PRO  64          HB1       PRO  64   6.645 -11.886  12.094
  468   1HG   PRO  64          HG2       PRO  64   3.823 -10.922  11.909
  469   2HG   PRO  64          HG1       PRO  64   4.433 -12.532  12.330
  470   1HD   PRO  64          HD2       PRO  64   3.618 -10.594  14.151
  471   2HD   PRO  64          HD1       PRO  64   4.656 -11.981  14.527
  472    H    ILE  65           HN       ILE  65   4.767  -8.025  13.703
  473    HA   ILE  65           HA       ILE  65   5.126  -6.415  11.267
  474    HB   ILE  65           HB       ILE  65   2.502  -6.953  12.646
  475   1HG1  ILE  65          HG12      ILE  65   3.558  -7.464   9.858
  476   2HG1  ILE  65          HG11      ILE  65   3.101  -8.667  11.059
  477   1HG2  ILE  65          HG21      ILE  65   1.523  -5.381  10.989
  478   2HG2  ILE  65          HG22      ILE  65   3.157  -4.908  10.523
  479   3HG2  ILE  65          HG23      ILE  65   2.580  -4.591  12.159
  480   1HD1  ILE  65          HD11      ILE  65   0.770  -7.925  10.882
  481   2HD1  ILE  65          HD12      ILE  65   1.416  -8.497   9.344
  482   3HD1  ILE  65          HD13      ILE  65   1.251  -6.767   9.642
  483    H    ILE  66           HN       ILE  66   5.696  -4.427  11.550
  484    HA   ILE  66           HA       ILE  66   5.038  -3.041  14.058
  485    HB   ILE  66           HB       ILE  66   7.255  -1.917  13.967
  486   1HG1  ILE  66          HG12      ILE  66   7.916  -4.072  11.947
  487   2HG1  ILE  66          HG11      ILE  66   7.721  -2.362  11.576
  488   1HG2  ILE  66          HG21      ILE  66   6.848  -3.772  15.495
  489   2HG2  ILE  66          HG22      ILE  66   8.518  -3.772  14.925
  490   3HG2  ILE  66          HG23      ILE  66   7.355  -4.914  14.250
  491   1HD1  ILE  66          HD11      ILE  66  10.060  -2.962  11.719
  492   2HD1  ILE  66          HD12      ILE  66   9.824  -3.558  13.362
  493   3HD1  ILE  66          HD13      ILE  66   9.624  -1.841  13.010
  494    H    GLU  67           HN       GLU  67   4.812  -0.778  13.849
  495    HA   GLU  67           HA       GLU  67   4.457   0.137  11.070
  496   1HB   GLU  67          HB2       GLU  67   2.326  -0.073  12.151
  497   2HB   GLU  67          HB1       GLU  67   2.902   0.772  13.578
  498   1HG   GLU  67          HG2       GLU  67   3.051   2.837  12.335
  499   2HG   GLU  67          HG1       GLU  67   2.581   2.003  10.854
  500    H    GLY  68           HN       GLY  68   5.195   2.182  10.514
  501   1HA   GLY  68          HA2       GLY  68   7.346   3.273  12.022
  502   2HA   GLY  68          HA1       GLY  68   6.576   4.025  10.629
  503    H    TYR  69           HN       TYR  69   7.054   4.225  13.946
  504    HA   TYR  69           HA       TYR  69   4.490   5.506  14.480
  505   1HB   TYR  69          HB2       TYR  69   5.352   3.807  16.064
  506   2HB   TYR  69          HB1       TYR  69   6.730   4.849  16.401
  507    HD1  TYR  69           HD1      TYR  69   6.559   5.773  18.510
  508    HD2  TYR  69           HD2      TYR  69   3.046   5.447  16.132
  509    HE1  TYR  69           HE1      TYR  69   5.270   6.914  20.267
  510    HE2  TYR  69           HE2      TYR  69   1.749   6.586  17.881
  511    HH   TYR  69           HH       TYR  69   3.297   7.989  20.704
  512    H    ASP  70           HN       ASP  70   7.968   6.290  14.586
  513    HA   ASP  70           HA       ASP  70   7.529   8.882  15.646
  514   1HB   ASP  70          HB2       ASP  70   9.823   9.288  15.469
  515   2HB   ASP  70          HB1       ASP  70   9.720   7.553  15.711
  516    HA   PRO  71           HA       PRO  71   7.338  10.521  11.246
  517   1HB   PRO  71          HB2       PRO  71   7.236   8.696   9.160
  518   2HB   PRO  71          HB1       PRO  71   8.693   9.516   9.721
  519   1HG   PRO  71          HG2       PRO  71   8.090   6.737   9.884
  520   2HG   PRO  71          HG1       PRO  71   9.511   7.575  10.527
  521   1HD   PRO  71          HD2       PRO  71   7.033   6.716  11.910
  522   2HD   PRO  71          HD1       PRO  71   8.670   6.951  12.559
  523    HA   PRO  72           HA       PRO  72   2.901   9.716  11.339
  524   1HB   PRO  72          HB2       PRO  72   2.656  12.347  10.094
  525   2HB   PRO  72          HB1       PRO  72   2.131  11.817  11.693
  526   1HG   PRO  72          HG2       PRO  72   4.181  13.544  11.336
  527   2HG   PRO  72          HG1       PRO  72   4.123  12.394  12.683
  528   1HD   PRO  72          HD2       PRO  72   5.640  12.215  10.105
  529   2HD   PRO  72          HD1       PRO  72   6.169  11.813  11.754
  530    H    GLU  73           HN       GLU  73   4.349   8.577   9.196
  531    HA   GLU  73           HA       GLU  73   3.095   9.481   6.733
  532   1HB   GLU  73          HB2       GLU  73   4.918   7.120   7.234
  533   2HB   GLU  73          HB1       GLU  73   4.436   7.737   5.660
  534   1HG   GLU  73          HG2       GLU  73   5.611   9.815   6.091
  535   2HG   GLU  73          HG1       GLU  73   6.053   9.245   7.700
  536    H    GLY  74           HN       GLY  74   3.213   6.493   8.669
  537   1HA   GLY  74          HA2       GLY  74   1.314   5.178   9.196
  538   2HA   GLY  74          HA1       GLY  74   0.459   5.921   7.853
  539    H    TRP  75           HN       TRP  75   3.146   3.728   8.591
  540    HA   TRP  75           HA       TRP  75   2.260   2.006   6.429
  541   1HB   TRP  75          HB2       TRP  75   4.644   1.732   5.622
  542   2HB   TRP  75          HB1       TRP  75   3.877   3.261   5.218
  543    HD1  TRP  75           HD1      TRP  75   4.946   5.454   6.166
  544    HE1  TRP  75           HE1      TRP  75   7.146   5.969   7.401
  545    HE3  TRP  75           HE3      TRP  75   6.303   0.680   7.415
  546    HZ2  TRP  75           HZ2      TRP  75   9.176   4.535   8.733
  547    HZ3  TRP  75           HZ3      TRP  75   8.391   0.342   8.670
  548    HH2  TRP  75           HH2      TRP  75   9.797   2.231   9.314
  549    H    GLY  76           HN       GLY  76   2.899  -0.150   6.639
  550   1HA   GLY  76          HA2       GLY  76   4.039  -0.798   9.289
  551   2HA   GLY  76          HA1       GLY  76   2.727  -1.712   8.558
  552    H    TRP  77           HN       TRP  77   5.576  -2.335   9.427
  553    HA   TRP  77           HA       TRP  77   6.499  -3.509   6.882
  554   1HB   TRP  77          HB2       TRP  77   8.099  -1.931   7.924
  555   2HB   TRP  77          HB1       TRP  77   8.094  -2.906   9.388
  556    HD1  TRP  77           HD1      TRP  77   9.574  -5.104   9.403
  557    HE1  TRP  77           HE1      TRP  77  11.366  -6.032   7.793
  558    HE3  TRP  77           HE3      TRP  77   8.707  -2.062   5.385
  559    HZ2  TRP  77           HZ2      TRP  77  12.280  -5.530   5.176
  560    HZ3  TRP  77           HZ3      TRP  77  10.086  -2.350   3.368
  561    HH2  TRP  77           HH2      TRP  77  11.835  -4.049   3.268
  562    H    CYS  78           HN       CYS  78   6.685  -5.671   6.743
  563    HA   CYS  78           HA       CYS  78   6.004  -7.226   9.155
  564   1HB   CYS  78          HB2       CYS  78   4.443  -7.232   7.106
  565   2HB   CYS  78          HB1       CYS  78   5.687  -8.182   6.314
  566    H    TYR  79           HN       TYR  79   7.744  -8.173  10.004
  567    HA   TYR  79           HA       TYR  79  10.286  -8.121   8.943
  568   1HB   TYR  79          HB2       TYR  79   9.076  -9.880  11.057
  569   2HB   TYR  79          HB1       TYR  79  10.781  -9.977  10.640
  570    HD1  TYR  79           HD1      TYR  79  12.085  -7.706  10.721
  571    HD2  TYR  79           HD2      TYR  79   8.405  -8.419  12.735
  572    HE1  TYR  79           HE1      TYR  79  12.590  -5.879  12.285
  573    HE2  TYR  79           HE2      TYR  79   8.898  -6.589  14.297
  574    HH   TYR  79           HH       TYR  79  10.964  -5.434  15.166
  575    H    VAL  80           HN       VAL  80   8.266 -11.063   9.160
  576    HA   VAL  80           HA       VAL  80  10.175 -12.657   7.801
  577    HB   VAL  80           HB       VAL  80   8.366 -14.380   7.700
  578   1HG1  VAL  80          HG11      VAL  80   9.895 -14.224   9.597
  579   2HG1  VAL  80          HG12      VAL  80   8.291 -14.746  10.110
  580   3HG1  VAL  80          HG13      VAL  80   8.806 -13.082  10.386
  581   1HG2  VAL  80          HG21      VAL  80   6.421 -12.953   7.507
  582   2HG2  VAL  80          HG22      VAL  80   6.752 -12.241   9.086
  583   3HG2  VAL  80          HG23      VAL  80   6.292 -13.940   8.963
  584    H    ASP  81           HN       ASP  81   7.703 -10.581   6.662
  585    HA   ASP  81           HA       ASP  81   7.534 -11.855   4.049
  586   1HB   ASP  81          HB2       ASP  81   6.329  -9.265   5.042
  587   2HB   ASP  81          HB1       ASP  81   5.999 -10.010   3.487
  588    H    GLU  82           HN       GLU  82   8.923  -9.068   5.617
  589    HA   GLU  82           HA       GLU  82  10.398  -7.477   5.013
  590   1HB   GLU  82          HB2       GLU  82  11.022  -9.395   2.768
  591   2HB   GLU  82          HB1       GLU  82  11.947  -7.940   3.114
  592   1HG   GLU  82          HG2       GLU  82  12.419  -8.834   5.371
  593   2HG   GLU  82          HG1       GLU  82  11.599 -10.326   4.910
  594    H    VAL  83           HN       VAL  83   7.672  -7.415   4.146
  595    HA   VAL  83           HA       VAL  83   7.976  -5.589   1.862
  596    HB   VAL  83           HB       VAL  83   5.671  -6.026   1.212
  597   1HG1  VAL  83          HG11      VAL  83   7.387  -7.386   0.185
  598   2HG1  VAL  83          HG12      VAL  83   5.913  -8.329   0.402
  599   3HG1  VAL  83          HG13      VAL  83   7.276  -8.560   1.496
  600   1HG2  VAL  83          HG21      VAL  83   4.357  -7.831   2.224
  601   2HG2  VAL  83          HG22      VAL  83   4.716  -6.556   3.389
  602   3HG2  VAL  83          HG23      VAL  83   5.620  -8.070   3.433
  603    H    MET  84           HN       MET  84   6.862  -3.649   1.937
  604    HA   MET  84           HA       MET  84   5.854  -2.890   4.605
  605   1HB   MET  84          HB2       MET  84   7.845  -1.632   3.863
  606   2HB   MET  84          HB1       MET  84   6.988  -1.137   2.410
  607   1HG   MET  84          HG2       MET  84   5.318  -0.003   3.868
  608   2HG   MET  84          HG1       MET  84   6.349  -0.377   5.248
  609   1HE   MET  84          HE1       MET  84   9.288   0.009   3.910
  610   2HE   MET  84          HE2       MET  84   8.812   0.524   5.528
  611   3HE   MET  84          HE3       MET  84   9.586   1.668   4.433
  612    H    PHE  85           HN       PHE  85   3.753  -2.313   4.775
  613    HA   PHE  85           HA       PHE  85   2.311  -1.784   2.260
  614   1HB   PHE  85          HB2       PHE  85   0.288  -2.779   3.366
  615   2HB   PHE  85          HB1       PHE  85   1.575  -3.923   3.013
  616    HD1  PHE  85           HD1      PHE  85  -0.311  -2.228   5.633
  617    HD2  PHE  85           HD2      PHE  85   2.847  -4.955   4.797
  618    HE1  PHE  85           HE1      PHE  85  -0.368  -3.006   7.966
  619    HE2  PHE  85           HE2      PHE  85   2.796  -5.732   7.130
  620    HZ   PHE  85           HZ       PHE  85   1.194  -4.752   8.719
  621    H    ASP  86           HN       ASP  86   0.117  -0.680   2.750
  622    HA   ASP  86           HA       ASP  86   0.893   1.788   4.081
  623   1HB   ASP  86          HB2       ASP  86  -0.026   1.899   1.803
  624   2HB   ASP  86          HB1       ASP  86  -1.526   1.172   2.373
  625    H    LEU  87           HN       LEU  87   0.031   2.584   5.870
  626    HA   LEU  87           HA       LEU  87  -2.444   1.419   6.936
  627   1HB   LEU  87          HB2       LEU  87   0.149   1.834   8.422
  628   2HB   LEU  87          HB1       LEU  87  -1.392   1.670   9.241
  629    HG   LEU  87           HG       LEU  87  -0.163  -0.431   7.454
  630   1HD1  LEU  87          HD11      LEU  87   0.240  -1.654   9.537
  631   2HD1  LEU  87          HD12      LEU  87  -0.336  -0.266  10.460
  632   3HD1  LEU  87          HD13      LEU  87   1.132  -0.133   9.492
  633   1HD2  LEU  87          HD21      LEU  87  -2.600  -0.513   7.495
  634   2HD2  LEU  87          HD22      LEU  87  -2.581  -0.500   9.259
  635   3HD2  LEU  87          HD23      LEU  87  -1.912  -1.876   8.380
  636    H    SER  88           HN       SER  88  -1.827   3.890   5.486
  637    HA   SER  88           HA       SER  88  -1.386   6.068   7.185
  638   1HB   SER  88          HB2       SER  88  -2.391   7.422   5.297
  639   2HB   SER  88          HB1       SER  88  -1.045   6.374   4.852
  640    HG   SER  88           HG       SER  88  -2.539   4.877   4.027
  641    H    ASP  89           HN       ASP  89  -4.380   4.413   6.344
  642    HA   ASP  89           HA       ASP  89  -5.933   6.442   7.771
  643   1HB   ASP  89          HB2       ASP  89  -6.625   4.207   5.922
  644   2HB   ASP  89          HB1       ASP  89  -7.841   4.745   7.075
  645    H    ARG  90           HN       ARG  90  -4.203   3.823   8.680
  646    HA   ARG  90           HA       ARG  90  -6.056   3.218  10.894
  647   1HB   ARG  90          HB2       ARG  90  -4.339   1.118   9.572
  648   2HB   ARG  90          HB1       ARG  90  -5.632   0.877  10.738
  649   1HG   ARG  90          HG2       ARG  90  -7.257   1.648   9.058
  650   2HG   ARG  90          HG1       ARG  90  -5.943   1.813   7.892
  651   1HD   ARG  90          HD2       ARG  90  -5.452  -0.647   8.372
  652   2HD   ARG  90          HD1       ARG  90  -7.037  -0.687   9.145
  653    HE   ARG  90           HE       ARG  90  -6.629   0.065   6.315
  654   1HH1  ARG  90          HH11      ARG  90  -8.494  -1.518   8.834
  655   2HH1  ARG  90          HH12      ARG  90  -9.625  -2.230   7.715
  656   1HH2  ARG  90          HH21      ARG  90  -8.129  -0.831   4.863
  657   2HH2  ARG  90          HH22      ARG  90  -9.421  -1.826   5.454
  658    H    MET  91           HN       MET  91  -3.565   4.863  10.465
  659    HA   MET  91           HA       MET  91  -1.393   3.493  11.696
  660   1HB   MET  91          HB2       MET  91  -0.263   5.677  11.651
  661   2HB   MET  91          HB1       MET  91  -0.979   5.276  10.097
  662   1HG   MET  91          HG2       MET  91  -2.847   6.762  10.554
  663   2HG   MET  91          HG1       MET  91  -2.176   7.135  12.140
  664   1HE   MET  91          HE1       MET  91   0.950   7.308  11.475
  665   2HE   MET  91          HE2       MET  91   0.086   8.438  12.517
  666   3HE   MET  91          HE3       MET  91   1.108   9.046  11.214
  667    H    THR  92           HN       THR  92  -0.474   3.789  13.711
  668    HA   THR  92           HA       THR  92  -2.247   4.329  15.870
  669    HB   THR  92           HB       THR  92   0.770   4.139  15.998
  670    HG1  THR  92           HG1      THR  92   0.095   2.268  15.008
  671   1HG2  THR  92          HG21      THR  92  -1.390   3.563  18.031
  672   2HG2  THR  92          HG22      THR  92  -0.292   4.944  18.045
  673   3HG2  THR  92          HG23      THR  92   0.338   3.313  18.274
  674    HA   PRO  93           HA       PRO  93  -1.730   8.765  15.697
  675   1HB   PRO  93          HB2       PRO  93  -3.240   8.714  18.221
  676   2HB   PRO  93          HB1       PRO  93  -3.649   9.479  16.683
  677   1HG   PRO  93          HG2       PRO  93  -4.947   7.300  17.561
  678   2HG   PRO  93          HG1       PRO  93  -4.625   7.568  15.838
  679   1HD   PRO  93          HD2       PRO  93  -3.196   5.788  17.778
  680   2HD   PRO  93          HD1       PRO  93  -3.654   5.476  16.089
  681    H    HIS  94           HN       HIS  94  -0.247  10.098  16.519
  682    HA   HIS  94           HA       HIS  94   1.609   9.291  18.477
  683   1HB   HIS  94          HB2       HIS  94   0.970  11.973  17.258
  684   2HB   HIS  94          HB1       HIS  94   2.218  11.790  18.484
  685    HD1  HIS  94           HD1      HIS  94   4.211  12.293  17.030
  686    HD2  HIS  94           HD2      HIS  94   1.804   9.277  15.482
  687    HE1  HIS  94           HE1      HIS  94   5.498  11.322  15.103
  688    HE2  HIS  94           HE2      HIS  94   4.153   9.315  14.400
  689    H    ASN  95           HN       ASN  95   1.735   9.611  20.638
  690    HA   ASN  95           HA       ASN  95  -0.693  10.643  21.913
  691   1HB   ASN  95          HB2       ASN  95  -0.038   9.336  23.864
  692   2HB   ASN  95          HB1       ASN  95  -0.062   8.321  22.429
  693   1HD2  ASN  95          HD21      ASN  95   1.295   7.809  24.877
  694   2HD2  ASN  95          HD22      ASN  95   2.981   7.699  24.506
  695    H    GLY  96           HN       GLY  96   1.922  12.083  20.973
  696   1HA   GLY  96          HA2       GLY  96   1.851  14.333  22.383
  697   2HA   GLY  96          HA1       GLY  96   2.736  13.297  23.492
  698    HA   PRO  97           HA       PRO  97   5.732  15.326  20.525
  699   1HB   PRO  97          HB2       PRO  97   7.066  16.317  22.921
  700   2HB   PRO  97          HB1       PRO  97   6.432  17.224  21.546
  701   1HG   PRO  97          HG2       PRO  97   5.313  17.323  24.013
  702   2HG   PRO  97          HG1       PRO  97   4.375  17.518  22.521
  703   1HD   PRO  97          HD2       PRO  97   4.666  15.108  24.278
  704   2HD   PRO  97          HD1       PRO  97   3.215  15.750  23.476
  705    H    ILE  98           HN       ILE  98   7.260  13.970  19.854
  706    HA   ILE  98           HA       ILE  98   8.435  12.080  21.752
  707    HB   ILE  98           HB       ILE  98   8.592  12.154  18.732
  708   1HG1  ILE  98          HG12      ILE  98   6.915  10.449  20.590
  709   2HG1  ILE  98          HG11      ILE  98   6.317  11.729  19.540
  710   1HG2  ILE  98          HG21      ILE  98   9.478  10.049  20.701
  711   2HG2  ILE  98          HG22      ILE  98  10.515  11.028  19.662
  712   3HG2  ILE  98          HG23      ILE  98   9.423   9.839  18.951
  713   1HD1  ILE  98          HD11      ILE  98   7.025  10.429  17.584
  714   2HD1  ILE  98          HD12      ILE  98   5.860   9.561  18.585
  715   3HD1  ILE  98          HD13      ILE  98   7.572   9.140  18.658
  716    HA   PRO  99           HA       PRO  99  12.228  14.475  21.855
  717   1HB   PRO  99          HB2       PRO  99  13.394  11.977  22.901
  718   2HB   PRO  99          HB1       PRO  99  13.310  13.575  23.648
  719   1HG   PRO  99          HG2       PRO  99  11.807  11.531  24.522
  720   2HG   PRO  99          HG1       PRO  99  11.210  13.201  24.529
  721   1HD   PRO  99          HD2       PRO  99  10.609  10.978  22.614
  722   2HD   PRO  99          HD1       PRO  99   9.521  12.206  23.294
  723    H    ARG 100           HN       ARG 100  13.173  14.755  19.917
  724    HA   ARG 100           HA       ARG 100  13.987  12.368  18.412
  725   1HB   ARG 100          HB2       ARG 100  12.432  14.017  17.332
  726   2HB   ARG 100          HB1       ARG 100  13.722  15.208  17.408
  727   1HG   ARG 100          HG2       ARG 100  14.393  12.644  16.118
  728   2HG   ARG 100          HG1       ARG 100  13.239  13.675  15.270
  729   1HD   ARG 100          HD2       ARG 100  15.931  14.589  16.269
  730   2HD   ARG 100          HD1       ARG 100  15.614  14.048  14.620
  731    HE   ARG 100           HE       ARG 100  14.065  16.288  15.722
  732   1HH1  ARG 100          HH11      ARG 100  16.471  15.094  13.477
  733   2HH1  ARG 100          HH12      ARG 100  16.420  16.514  12.474
  734   1HH2  ARG 100          HH21      ARG 100  14.015  18.153  14.437
  735   2HH2  ARG 100          HH22      ARG 100  15.048  18.283  13.045
  736    H    TYR 101           HN       TYR 101  16.062  11.905  18.105
  737    HA   TYR 101           HA       TYR 101  18.003  13.674  19.407
  738   1HB   TYR 101          HB2       TYR 101  18.204  10.766  18.597
  739   2HB   TYR 101          HB1       TYR 101  19.489  11.679  19.378
  740    HD1  TYR 101           HD1      TYR 101  19.403  12.178  21.733
  741    HD2  TYR 101           HD2      TYR 101  16.179  10.143  19.843
  742    HE1  TYR 101           HE1      TYR 101  18.512  11.552  23.937
  743    HE2  TYR 101           HE2      TYR 101  15.279   9.517  22.042
  744    HH   TYR 101           HH       TYR 101  16.402  10.894  24.958
  745    H    VAL 102           HN       VAL 102  17.560  11.846  16.390
  746    HA   VAL 102           HA       VAL 102  19.945  13.150  15.313
  747    HB   VAL 102           HB       VAL 102  19.671  11.504  13.400
  748   1HG1  VAL 102          HG11      VAL 102  20.121  10.436  16.186
  749   2HG1  VAL 102          HG12      VAL 102  21.327  11.195  15.147
  750   3HG1  VAL 102          HG13      VAL 102  20.627   9.641  14.695
  751   1HG2  VAL 102          HG21      VAL 102  18.345   9.490  13.852
  752   2HG2  VAL 102          HG22      VAL 102  17.326  10.925  13.743
  753   3HG2  VAL 102          HG23      VAL 102  17.714  10.238  15.320
  Start of MODEL    8
    1   1H    MET   1          HT1       MET   1   5.219   1.000  -1.689
    2   2H    MET   1          HT2       MET   1   3.903   0.527  -2.646
    3   3H    MET   1          HT3       MET   1   5.324  -0.396  -2.645
    4    HA   MET   1           HA       MET   1   5.004  -1.015  -0.375
    5   1HB   MET   1          HB2       MET   1   3.160  -0.297   0.927
    6   2HB   MET   1          HB1       MET   1   3.799   1.160   0.184
    7   1HG   MET   1          HG2       MET   1   1.377  -0.379  -0.726
    8   2HG   MET   1          HG1       MET   1   1.372   1.142   0.161
    9   1HE   MET   1          HE1       MET   1   0.074   2.190  -3.378
   10   2HE   MET   1          HE2       MET   1  -0.244   2.215  -1.643
   11   3HE   MET   1          HE3       MET   1  -0.258   0.685  -2.521
   12    H    THR   2           HN       THR   2   3.528  -2.755   0.272
   13    HA   THR   2           HA       THR   2   2.090  -3.882  -2.035
   14    HB   THR   2           HB       THR   2   3.896  -5.292  -1.069
   15    HG1  THR   2           HG1      THR   2   2.268  -6.443  -2.034
   16   1HG2  THR   2          HG21      THR   2   3.583  -6.334   1.127
   17   2HG2  THR   2          HG22      THR   2   2.157  -5.332   1.398
   18   3HG2  THR   2          HG23      THR   2   3.748  -4.583   1.260
   19    H    MET   3           HN       MET   3   0.072  -5.146  -1.409
   20    HA   MET   3           HA       MET   3  -1.721  -3.478   0.006
   21   1HB   MET   3          HB2       MET   3  -1.969  -6.323  -0.967
   22   2HB   MET   3          HB1       MET   3  -3.285  -5.473  -0.169
   23   1HG   MET   3          HG2       MET   3  -1.937  -4.629  -2.724
   24   2HG   MET   3          HG1       MET   3  -3.508  -5.420  -2.593
   25   1HE   MET   3          HE1       MET   3  -4.661  -3.516  -4.021
   26   2HE   MET   3          HE2       MET   3  -3.097  -2.722  -4.206
   27   3HE   MET   3          HE3       MET   3  -4.500  -1.795  -3.673
   28    H    GLY   4           HN       GLY   4  -0.062  -6.479   0.868
   29   1HA   GLY   4          HA2       GLY   4   0.536  -6.012   3.426
   30   2HA   GLY   4          HA1       GLY   4  -1.173  -6.398   3.553
   31    H    CYS   5           HN       CYS   5  -0.791  -8.236   4.761
   32    HA   CYS   5           HA       CYS   5  -0.423 -10.578   3.163
   33   1HB   CYS   5          HB2       CYS   5   1.402 -11.560   4.390
   34   2HB   CYS   5          HB1       CYS   5   1.925  -9.994   3.785
   35    H    ARG   6           HN       ARG   6  -0.893 -12.566   4.493
   36    HA   ARG   6           HA       ARG   6  -3.287 -12.210   5.881
   37   1HB   ARG   6          HB2       ARG   6  -2.953 -14.624   6.593
   38   2HB   ARG   6          HB1       ARG   6  -2.948 -14.301   4.865
   39   1HG   ARG   6          HG2       ARG   6  -0.520 -14.401   4.838
   40   2HG   ARG   6          HG1       ARG   6  -0.504 -14.681   6.581
   41   1HD   ARG   6          HD2       ARG   6  -1.993 -16.482   4.700
   42   2HD   ARG   6          HD1       ARG   6  -0.278 -16.710   5.039
   43    HE   ARG   6           HE       ARG   6  -1.090 -16.781   7.480
   44   1HH1  ARG   6          HH11      ARG   6  -2.993 -17.905   4.764
   45   2HH1  ARG   6          HH12      ARG   6  -3.718 -19.206   5.655
   46   1HH2  ARG   6          HH21      ARG   6  -2.046 -18.489   8.644
   47   2HH2  ARG   6          HH22      ARG   6  -3.167 -19.557   7.846
   48    H    HIS   7           HN       HIS   7  -0.037 -12.127   7.092
   49    HA   HIS   7           HA       HIS   7  -0.524 -12.614   9.816
   50   1HB   HIS   7          HB2       HIS   7   1.526 -10.787   8.551
   51   2HB   HIS   7          HB1       HIS   7   1.520 -11.262  10.244
   52    HD2  HIS   7           HD2      HIS   7   1.117 -14.462   9.917
   53    HE1  HIS   7           HE1      HIS   7   4.556 -14.170   7.469
   54    HE2  HIS   7           HE2      HIS   7   3.208 -15.692   8.987
   55    H    VAL   8           HN       VAL   8  -1.304  -9.913   7.817
   56    HA   VAL   8           HA       VAL   8  -1.375  -7.868   9.741
   57    HB   VAL   8           HB       VAL   8  -1.829  -7.987   7.030
   58   1HG1  VAL   8          HG11      VAL   8  -4.418  -7.146   8.317
   59   2HG1  VAL   8          HG12      VAL   8  -4.175  -8.603   7.351
   60   3HG1  VAL   8          HG13      VAL   8  -4.012  -7.012   6.606
   61   1HG2  VAL   8          HG21      VAL   8  -2.111  -5.563   7.173
   62   2HG2  VAL   8          HG22      VAL   8  -0.832  -6.138   8.243
   63   3HG2  VAL   8          HG23      VAL   8  -2.408  -5.704   8.905
   64    H    ALA   9           HN       ALA   9  -3.588 -10.466   9.047
   65    HA   ALA   9           HA       ALA   9  -5.826  -9.368  10.445
   66   1HB   ALA   9          HB1       ALA   9  -6.113 -11.084   8.739
   67   2HB   ALA   9          HB2       ALA   9  -6.768 -11.621  10.287
   68   3HB   ALA   9          HB3       ALA   9  -5.211 -12.232   9.727
   69    H    GLY  10           HN       GLY  10  -2.874 -10.374  11.547
   70   1HA   GLY  10          HA2       GLY  10  -3.935 -11.385  14.097
   71   2HA   GLY  10          HA1       GLY  10  -2.271 -11.537  13.549
   72    H    ILE  11           HN       ILE  11  -2.981  -8.492  12.737
   73    HA   ILE  11           HA       ILE  11  -1.981  -7.457  15.294
   74    HB   ILE  11           HB       ILE  11  -1.288  -5.447  14.099
   75   1HG1  ILE  11          HG12      ILE  11  -2.252  -6.859  11.603
   76   2HG1  ILE  11          HG11      ILE  11  -3.054  -5.489  12.360
   77   1HG2  ILE  11          HG21      ILE  11   0.280  -7.280  14.305
   78   2HG2  ILE  11          HG22      ILE  11   0.512  -6.446  12.769
   79   3HG2  ILE  11          HG23      ILE  11  -0.327  -7.996  12.812
   80   1HD1  ILE  11          HD11      ILE  11  -0.291  -5.464  11.176
   81   2HD1  ILE  11          HD12      ILE  11  -1.131  -4.088  11.893
   82   3HD1  ILE  11          HD13      ILE  11  -1.752  -4.831  10.417
   83    H    ARG  12           HN       ARG  12  -2.839  -5.518  16.154
   84    HA   ARG  12           HA       ARG  12  -5.540  -4.849  15.217
   85   1HB   ARG  12          HB2       ARG  12  -6.134  -4.435  17.646
   86   2HB   ARG  12          HB1       ARG  12  -5.956  -6.120  17.181
   87   1HG   ARG  12          HG2       ARG  12  -3.580  -4.741  18.300
   88   2HG   ARG  12          HG1       ARG  12  -4.898  -5.147  19.401
   89   1HD   ARG  12          HD2       ARG  12  -3.536  -7.105  17.551
   90   2HD   ARG  12          HD1       ARG  12  -3.149  -6.904  19.261
   91    HE   ARG  12           HE       ARG  12  -5.755  -7.393  19.406
   92   1HH1  ARG  12          HH11      ARG  12  -3.276  -9.014  17.531
   93   2HH1  ARG  12          HH12      ARG  12  -4.073 -10.552  17.569
   94   1HH2  ARG  12          HH21      ARG  12  -6.819  -9.404  19.432
   95   2HH2  ARG  12          HH22      ARG  12  -6.100 -10.772  18.629
   96    H    THR  13           HN       THR  13  -6.245  -2.675  15.909
   97    HA   THR  13           HA       THR  13  -4.188  -0.727  15.601
   98    HB   THR  13           HB       THR  13  -7.016  -0.265  16.574
   99    HG1  THR  13           HG1      THR  13  -7.571  -0.102  14.390
  100   1HG2  THR  13          HG21      THR  13  -5.515   1.660  16.812
  101   2HG2  THR  13          HG22      THR  13  -6.721   1.949  15.559
  102   3HG2  THR  13          HG23      THR  13  -5.068   1.528  15.111
  103    H    VAL  14           HN       VAL  14  -2.721  -0.618  17.170
  104    HA   VAL  14           HA       VAL  14  -3.520  -1.127  19.924
  105    HB   VAL  14           HB       VAL  14  -1.057  -1.288  20.338
  106   1HG1  VAL  14          HG11      VAL  14  -2.138  -3.064  18.160
  107   2HG1  VAL  14          HG12      VAL  14  -2.412  -3.267  19.890
  108   3HG1  VAL  14          HG13      VAL  14  -0.786  -3.438  19.228
  109   1HG2  VAL  14          HG21      VAL  14   0.440  -1.445  18.406
  110   2HG2  VAL  14          HG22      VAL  14  -0.294   0.155  18.521
  111   3HG2  VAL  14          HG23      VAL  14  -0.894  -1.007  17.338
  112    H    THR  15           HN       THR  15  -2.615   0.138  21.657
  113    HA   THR  15           HA       THR  15  -2.457   2.985  20.980
  114    HB   THR  15           HB       THR  15  -2.827   1.730  23.710
  115    HG1  THR  15           HG1      THR  15  -4.725   2.562  21.746
  116   1HG2  THR  15          HG21      THR  15  -3.706   3.941  24.318
  117   2HG2  THR  15          HG22      THR  15  -3.363   4.527  22.690
  118   3HG2  THR  15          HG23      THR  15  -2.039   4.049  23.753
  119    HA   PRO  16           HA       PRO  16   1.974   2.773  21.477
  120   1HB   PRO  16          HB2       PRO  16   1.653   5.671  22.046
  121   2HB   PRO  16          HB1       PRO  16   2.679   4.862  20.857
  122   1HG   PRO  16          HG2       PRO  16   0.460   6.146  20.114
  123   2HG   PRO  16          HG1       PRO  16   0.960   4.638  19.326
  124   1HD   PRO  16          HD2       PRO  16  -1.194   5.105  21.340
  125   2HD   PRO  16          HD1       PRO  16  -1.161   3.993  19.957
  126    H    SER  17           HN       SER  17   2.859   1.997  23.266
  127    HA   SER  17           HA       SER  17   1.987   2.911  25.875
  128   1HB   SER  17          HB2       SER  17   2.352   0.483  25.316
  129   2HB   SER  17          HB1       SER  17   4.079   0.825  25.219
  130    HG   SER  17           HG       SER  17   4.051   1.412  27.400
  131    H    ALA  18           HN       ALA  18   4.441   3.694  23.682
  132    HA   ALA  18           HA       ALA  18   5.840   5.227  25.740
  133   1HB   ALA  18          HB1       ALA  18   7.118   3.135  25.444
  134   2HB   ALA  18          HB2       ALA  18   8.028   4.552  24.919
  135   3HB   ALA  18          HB3       ALA  18   7.277   3.495  23.724
  136    H    LEU  19           HN       LEU  19   7.004   7.051  24.892
  137    HA   LEU  19           HA       LEU  19   5.867   8.057  22.403
  138   1HB   LEU  19          HB2       LEU  19   7.656   9.353  24.466
  139   2HB   LEU  19          HB1       LEU  19   7.041  10.167  23.041
  140    HG   LEU  19           HG       LEU  19   5.341   9.050  25.273
  141   1HD1  LEU  19          HD11      LEU  19   4.922  11.403  25.820
  142   2HD1  LEU  19          HD12      LEU  19   6.096  11.889  24.595
  143   3HD1  LEU  19          HD13      LEU  19   6.623  10.975  26.008
  144   1HD2  LEU  19          HD21      LEU  19   3.521  10.252  24.171
  145   2HD2  LEU  19          HD22      LEU  19   4.207   9.017  23.116
  146   3HD2  LEU  19          HD23      LEU  19   4.613  10.715  22.866
  147    H    GLY  20           HN       GLY  20   9.106   7.846  23.839
  148   1HA   GLY  20          HA2       GLY  20  10.245   7.732  21.137
  149   2HA   GLY  20          HA1       GLY  20  11.135   8.100  22.610
  150    H    CYS  21           HN       CYS  21  12.695   6.499  22.150
  151    HA   CYS  21           HA       CYS  21  11.898   3.761  21.850
  152   1HB   CYS  21          HB2       CYS  21  13.978   4.498  20.835
  153   2HB   CYS  21          HB1       CYS  21  14.605   4.987  22.406
  154    HG   CYS  21           HG       CYS  21  15.993   2.725  21.893
  155    H    GLU  22           HN       GLU  22  10.972   2.769  23.474
  156    HA   GLU  22           HA       GLU  22  10.934   3.362  26.142
  157   1HB   GLU  22          HB2       GLU  22   9.531   1.682  24.916
  158   2HB   GLU  22          HB1       GLU  22  10.888   0.570  24.987
  159   1HG   GLU  22          HG2       GLU  22   9.507  -0.075  26.732
  160   2HG   GLU  22          HG1       GLU  22  10.780   0.864  27.509
  161    H    GLU  23           HN       GLU  23  13.328   1.450  24.409
  162    HA   GLU  23           HA       GLU  23  14.676   0.521  26.752
  163   1HB   GLU  23          HB2       GLU  23  14.737  -0.721  24.634
  164   2HB   GLU  23          HB1       GLU  23  15.588   0.614  23.872
  165   1HG   GLU  23          HG2       GLU  23  17.115  -1.175  24.433
  166   2HG   GLU  23          HG1       GLU  23  17.482   0.273  25.369
  167    H    CYS  24           HN       CYS  24  15.368   3.018  24.320
  168    HA   CYS  24           HA       CYS  24  17.857   3.754  25.420
  169   1HB   CYS  24          HB2       CYS  24  15.974   5.239  23.589
  170   2HB   CYS  24          HB1       CYS  24  17.593   5.799  23.995
  171    HG   CYS  24           HG       CYS  24  18.374   4.757  21.755
  172    H    LEU  25           HN       LEU  25  14.586   4.730  26.146
  173    HA   LEU  25           HA       LEU  25  15.175   7.203  27.377
  174   1HB   LEU  25          HB2       LEU  25  12.835   5.333  27.683
  175   2HB   LEU  25          HB1       LEU  25  12.913   6.913  28.438
  176    HG   LEU  25           HG       LEU  25  12.976   6.392  25.464
  177   1HD1  LEU  25          HD11      LEU  25  10.792   5.939  26.460
  178   2HD1  LEU  25          HD12      LEU  25  10.754   7.390  25.459
  179   3HD1  LEU  25          HD13      LEU  25  10.804   7.532  27.216
  180   1HD2  LEU  25          HD21      LEU  25  12.768   8.820  25.265
  181   2HD2  LEU  25          HD22      LEU  25  14.259   8.367  26.093
  182   3HD2  LEU  25          HD23      LEU  25  12.886   8.975  27.018
  183    H    LYS  26           HN       LYS  26  15.630   3.988  28.497
  184    HA   LYS  26           HA       LYS  26  15.278   4.541  31.281
  185   1HB   LYS  26          HB2       LYS  26  16.012   2.333  31.681
  186   2HB   LYS  26          HB1       LYS  26  15.116   2.264  30.171
  187   1HG   LYS  26          HG2       LYS  26  17.383   2.474  29.016
  188   2HG   LYS  26          HG1       LYS  26  18.079   2.107  30.595
  189   1HD   LYS  26          HD2       LYS  26  16.129   0.387  29.068
  190   2HD   LYS  26          HD1       LYS  26  17.859   0.091  29.241
  191   1HE   LYS  26          HE2       LYS  26  17.622  -0.255  31.602
  192   2HE   LYS  26          HE1       LYS  26  15.932   0.248  31.554
  193   1HZ   LYS  26          HZ1       LYS  26  17.040  -2.150  30.197
  194   2HZ   LYS  26          HZ2       LYS  26  15.416  -1.675  30.209
  195   3HZ   LYS  26          HZ3       LYS  26  16.170  -2.165  31.648
  196    H    ILE  27           HN       ILE  27  17.824   5.057  29.039
  197    HA   ILE  27           HA       ILE  27  19.632   5.739  31.263
  198    HB   ILE  27           HB       ILE  27  21.542   5.141  29.741
  199   1HG1  ILE  27          HG12      ILE  27  19.347   3.756  28.184
  200   2HG1  ILE  27          HG11      ILE  27  20.285   5.136  27.626
  201   1HG2  ILE  27          HG21      ILE  27  19.692   2.916  30.587
  202   2HG2  ILE  27          HG22      ILE  27  20.895   3.718  31.597
  203   3HG2  ILE  27          HG23      ILE  27  21.409   2.739  30.223
  204   1HD1  ILE  27          HD11      ILE  27  21.361   2.391  28.224
  205   2HD1  ILE  27          HD12      ILE  27  22.310   3.774  27.680
  206   3HD1  ILE  27          HD13      ILE  27  21.078   3.081  26.626
  207    H    GLY  28           HN       GLY  28  17.874   6.941  28.765
  208   1HA   GLY  28          HA2       GLY  28  17.837   9.068  27.855
  209   2HA   GLY  28          HA1       GLY  28  19.324   9.425  28.722
  210    H    SER  29           HN       SER  29  18.854   6.730  26.550
  211    HA   SER  29           HA       SER  29  21.127   7.590  24.969
  212   1HB   SER  29          HB2       SER  29  20.896   5.227  25.684
  213   2HB   SER  29          HB1       SER  29  19.397   5.105  24.766
  214    HG   SER  29           HG       SER  29  22.023   5.534  23.765
  215    HA   PRO  30           HA       PRO  30  18.583   9.267  21.713
  216   1HB   PRO  30          HB2       PRO  30  20.767   8.805  19.843
  217   2HB   PRO  30          HB1       PRO  30  20.152  10.333  20.475
  218   1HG   PRO  30          HG2       PRO  30  22.589   9.335  21.139
  219   2HG   PRO  30          HG1       PRO  30  21.632  10.354  22.228
  220   1HD   PRO  30          HD2       PRO  30  21.961   7.376  22.218
  221   2HD   PRO  30          HD1       PRO  30  21.924   8.501  23.594
  222    H    TRP  31           HN       TRP  31  17.936   8.723  19.437
  223    HA   TRP  31           HA       TRP  31  18.350   5.986  18.599
  224   1HB   TRP  31          HB2       TRP  31  15.915   5.543  18.367
  225   2HB   TRP  31          HB1       TRP  31  16.421   5.705  20.043
  226    HD1  TRP  31           HD1      TRP  31  14.493   7.638  17.318
  227    HE1  TRP  31           HE1      TRP  31  12.924   9.314  18.481
  228    HE3  TRP  31           HE3      TRP  31  16.034   6.975  22.148
  229    HZ2  TRP  31           HZ2      TRP  31  12.406  10.229  21.098
  230    HZ3  TRP  31           HZ3      TRP  31  14.950   8.288  23.922
  231    HH2  TRP  31           HH2      TRP  31  13.174   9.882  23.406
  232    H    VAL  32           HN       VAL  32  17.595   5.622  16.404
  233    HA   VAL  32           HA       VAL  32  17.746   8.078  14.845
  234    HB   VAL  32           HB       VAL  32  17.668   5.237  13.811
  235   1HG1  VAL  32          HG11      VAL  32  18.661   6.206  11.799
  236   2HG1  VAL  32          HG12      VAL  32  18.593   7.808  12.531
  237   3HG1  VAL  32          HG13      VAL  32  17.100   6.945  12.160
  238   1HG2  VAL  32          HG21      VAL  32  20.116   5.419  13.617
  239   2HG2  VAL  32          HG22      VAL  32  19.573   5.487  15.293
  240   3HG2  VAL  32          HG23      VAL  32  20.055   6.966  14.463
  241    H    HIS  33           HN       HIS  33  15.734   5.118  14.614
  242    HA   HIS  33           HA       HIS  33  13.431   6.881  14.139
  243   1HB   HIS  33          HB2       HIS  33  13.988   4.332  12.601
  244   2HB   HIS  33          HB1       HIS  33  12.561   5.346  12.434
  245    HD1  HIS  33           HD1      HIS  33  13.208   7.950  11.654
  246    HD2  HIS  33           HD2      HIS  33  15.895   4.884  10.785
  247    HE1  HIS  33           HE1      HIS  33  14.713   8.845   9.840
  248    HE2  HIS  33           HE2      HIS  33  16.435   7.038   9.459
  249    H    LEU  34           HN       LEU  34  11.354   5.842  14.573
  250    HA   LEU  34           HA       LEU  34  11.625   3.879  16.746
  251   1HB   LEU  34          HB2       LEU  34   9.544   6.016  16.305
  252   2HB   LEU  34          HB1       LEU  34   9.488   4.825  17.592
  253    HG   LEU  34           HG       LEU  34  11.660   6.892  17.244
  254   1HD1  LEU  34          HD11      LEU  34   9.524   7.903  17.845
  255   2HD1  LEU  34          HD12      LEU  34  10.662   7.971  19.190
  256   3HD1  LEU  34          HD13      LEU  34   9.363   6.778  19.193
  257   1HD2  LEU  34          HD21      LEU  34  11.108   4.932  19.470
  258   2HD2  LEU  34          HD22      LEU  34  12.353   6.181  19.482
  259   3HD2  LEU  34          HD23      LEU  34  12.446   4.854  18.324
  260    H    ARG  35           HN       ARG  35  10.326   2.127  16.831
  261    HA   ARG  35           HA       ARG  35   8.470   1.702  14.575
  262   1HB   ARG  35          HB2       ARG  35  10.071  -0.431  16.006
  263   2HB   ARG  35          HB1       ARG  35   9.040  -0.653  14.602
  264   1HG   ARG  35          HG2       ARG  35  11.581   0.960  14.649
  265   2HG   ARG  35          HG1       ARG  35  11.428  -0.691  14.051
  266   1HD   ARG  35          HD2       ARG  35   9.785   0.110  12.385
  267   2HD   ARG  35          HD1       ARG  35  10.061   1.759  12.948
  268    HE   ARG  35           HE       ARG  35  12.282   0.130  11.886
  269   1HH1  ARG  35          HH11      ARG  35  10.279   2.998  11.788
  270   2HH1  ARG  35          HH12      ARG  35  11.264   3.815  10.610
  271   1HH2  ARG  35          HH21      ARG  35  13.599   1.193  10.345
  272   2HH2  ARG  35          HH22      ARG  35  13.149   2.778   9.780
  273    H    ILE  36           HN       ILE  36   6.420   1.602  15.287
  274    HA   ILE  36           HA       ILE  36   5.930   0.706  18.039
  275    HB   ILE  36           HB       ILE  36   4.828   2.787  17.506
  276   1HG1  ILE  36          HG12      ILE  36   2.813   0.531  17.559
  277   2HG1  ILE  36          HG11      ILE  36   3.669   1.156  18.964
  278   1HG2  ILE  36          HG21      ILE  36   4.699   2.617  15.098
  279   2HG2  ILE  36          HG22      ILE  36   3.099   2.945  15.765
  280   3HG2  ILE  36          HG23      ILE  36   3.513   1.318  15.228
  281   1HD1  ILE  36          HD11      ILE  36   1.722   2.671  17.245
  282   2HD1  ILE  36          HD12      ILE  36   2.601   3.333  18.623
  283   3HD1  ILE  36          HD13      ILE  36   1.426   2.040  18.865
  284    H    CYS  37           HN       CYS  37   5.320  -1.224  18.437
  285    HA   CYS  37           HA       CYS  37   4.984  -3.116  16.305
  286   1HB   CYS  37          HB2       CYS  37   6.306  -3.644  18.258
  287   2HB   CYS  37          HB1       CYS  37   4.928  -3.351  19.308
  288    H    ARG  38           HN       ARG  38   3.100  -3.566  15.366
  289    HA   ARG  38           HA       ARG  38   0.651  -2.461  16.342
  290   1HB   ARG  38          HB2       ARG  38   1.379  -4.146  13.964
  291   2HB   ARG  38          HB1       ARG  38  -0.293  -3.739  14.319
  292   1HG   ARG  38          HG2       ARG  38   1.891  -1.711  13.928
  293   2HG   ARG  38          HG1       ARG  38   0.794  -2.255  12.658
  294   1HD   ARG  38          HD2       ARG  38  -0.024  -0.935  15.244
  295   2HD   ARG  38          HD1       ARG  38   0.061  -0.143  13.671
  296    HE   ARG  38           HE       ARG  38  -1.749  -2.425  14.121
  297   1HH1  ARG  38          HH11      ARG  38  -1.155   0.868  13.121
  298   2HH1  ARG  38          HH12      ARG  38  -2.793   1.142  12.595
  299   1HH2  ARG  38          HH21      ARG  38  -3.903  -2.095  13.384
  300   2HH2  ARG  38          HH22      ARG  38  -4.350  -0.540  12.756
  301    H    THR  39           HN       THR  39   2.104  -5.080  17.530
  302    HA   THR  39           HA       THR  39  -0.359  -6.672  17.626
  303    HB   THR  39           HB       THR  39   2.356  -7.602  18.543
  304    HG1  THR  39           HG1      THR  39   1.309  -8.223  15.993
  305   1HG2  THR  39          HG21      THR  39  -0.111  -9.067  17.594
  306   2HG2  THR  39          HG22      THR  39   0.440  -8.934  19.266
  307   3HG2  THR  39          HG23      THR  39   1.407  -9.820  18.085
  308    H    CYS  40           HN       CYS  40   1.733  -4.738  19.583
  309    HA   CYS  40           HA       CYS  40   0.077  -5.362  21.901
  310   1HB   CYS  40          HB2       CYS  40   1.968  -5.756  23.371
  311   2HB   CYS  40          HB1       CYS  40   2.038  -6.864  22.010
  312    H    GLY  41           HN       GLY  41   1.646  -3.055  20.015
  313   1HA   GLY  41          HA2       GLY  41   1.354  -0.771  20.162
  314   2HA   GLY  41          HA1       GLY  41   0.644  -0.994  21.750
  315    H    HIS  42           HN       HIS  42   3.718  -2.476  21.427
  316    HA   HIS  42           HA       HIS  42   4.804  -0.364  23.123
  317   1HB   HIS  42          HB2       HIS  42   5.051  -3.097  23.271
  318   2HB   HIS  42          HB1       HIS  42   6.579  -2.625  22.531
  319    HD1  HIS  42           HD1      HIS  42   5.713  -3.553  25.639
  320    HD2  HIS  42           HD2      HIS  42   7.213   0.067  24.248
  321    HE1  HIS  42           HE1      HIS  42   6.701  -2.406  27.650
  322    HE2  HIS  42           HE2      HIS  42   7.439  -0.142  26.815
  323    H    VAL  43           HN       VAL  43   6.502   0.915  22.594
  324    HA   VAL  43           HA       VAL  43   7.288   0.878  19.763
  325    HB   VAL  43           HB       VAL  43   7.373   3.204  21.698
  326   1HG1  VAL  43          HG11      VAL  43   7.726   4.570  19.705
  327   2HG1  VAL  43          HG12      VAL  43   7.731   3.118  18.704
  328   3HG1  VAL  43          HG13      VAL  43   9.008   3.374  19.893
  329   1HG2  VAL  43          HG21      VAL  43   5.434   4.073  20.476
  330   2HG2  VAL  43          HG22      VAL  43   5.072   2.539  21.269
  331   3HG2  VAL  43          HG23      VAL  43   5.368   2.585  19.531
  332    H    GLY  44           HN       GLY  44   9.398   0.799  19.204
  333   1HA   GLY  44          HA2       GLY  44  11.438   1.234  21.267
  334   2HA   GLY  44          HA1       GLY  44  11.427  -0.310  20.423
  335    H    CYS  45           HN       CYS  45  13.674   1.203  20.253
  336    HA   CYS  45           HA       CYS  45  13.667   2.898  17.953
  337   1HB   CYS  45          HB2       CYS  45  16.083   2.896  18.162
  338   2HB   CYS  45          HB1       CYS  45  15.374   3.055  19.766
  339    HG   CYS  45           HG       CYS  45  16.779   0.240  18.427
  340    H    CYS  46           HN       CYS  46  14.449   2.447  15.894
  341    HA   CYS  46           HA       CYS  46  13.884  -0.146  14.898
  342   1HB   CYS  46          HB2       CYS  46  14.718   0.774  12.748
  343   2HB   CYS  46          HB1       CYS  46  13.529   1.816  13.524
  344    HG   CYS  46           HG       CYS  46  16.283   2.744  12.299
  345    H    ASP  47           HN       ASP  47  15.733  -0.811  13.095
  346    HA   ASP  47           HA       ASP  47  17.797  -1.944  14.758
  347   1HB   ASP  47          HB2       ASP  47  18.378  -3.242  12.750
  348   2HB   ASP  47          HB1       ASP  47  16.658  -3.343  13.112
  349    H    ASP  48           HN       ASP  48  17.542   0.956  13.322
  350    HA   ASP  48           HA       ASP  48  20.182   1.197  12.204
  351   1HB   ASP  48          HB2       ASP  48  18.151   3.301  12.985
  352   2HB   ASP  48          HB1       ASP  48  19.673   3.642  12.171
  353    H    SER  49           HN       SER  49  18.616   1.862  15.266
  354    HA   SER  49           HA       SER  49  20.959   3.082  16.416
  355   1HB   SER  49          HB2       SER  49  18.334   2.201  17.647
  356   2HB   SER  49          HB1       SER  49  19.604   3.070  18.510
  357    HG   SER  49           HG       SER  49  19.321   4.818  17.136
  358    HA   PRO  50           HA       PRO  50  23.290  -0.392  17.689
  359   1HB   PRO  50          HB2       PRO  50  23.260   0.868  20.396
  360   2HB   PRO  50          HB1       PRO  50  24.627   0.283  19.441
  361   1HG   PRO  50          HG2       PRO  50  24.105   2.889  19.626
  362   2HG   PRO  50          HG1       PRO  50  24.679   2.174  18.109
  363   1HD   PRO  50          HD2       PRO  50  21.959   3.125  18.842
  364   2HD   PRO  50          HD1       PRO  50  22.763   3.100  17.262
  365    H    HIS  51           HN       HIS  51  20.681   0.575  19.890
  366    HA   HIS  51           HA       HIS  51  20.638  -1.830  21.374
  367   1HB   HIS  51          HB2       HIS  51  18.727   0.448  21.050
  368   2HB   HIS  51          HB1       HIS  51  18.198  -1.014  21.874
  369    HD1  HIS  51           HD1      HIS  51  19.186   2.121  22.819
  370    HD2  HIS  51           HD2      HIS  51  20.648  -1.640  23.817
  371    HE1  HIS  51           HE1      HIS  51  20.290   2.396  25.059
  372    HE2  HIS  51           HE2      HIS  51  21.370   0.164  25.526
  373    H    LYS  52           HN       LYS  52  18.824  -0.791  18.513
  374    HA   LYS  52           HA       LYS  52  17.318  -1.853  17.160
  375   1HB   LYS  52          HB2       LYS  52  19.025  -4.251  17.861
  376   2HB   LYS  52          HB1       LYS  52  17.934  -4.138  16.488
  377   1HG   LYS  52          HG2       LYS  52  19.315  -2.230  15.654
  378   2HG   LYS  52          HG1       LYS  52  20.462  -2.578  16.950
  379   1HD   LYS  52          HD2       LYS  52  20.754  -4.847  16.071
  380   2HD   LYS  52          HD1       LYS  52  19.618  -4.486  14.769
  381   1HE   LYS  52          HE2       LYS  52  21.136  -2.647  14.049
  382   2HE   LYS  52          HE1       LYS  52  22.294  -3.188  15.263
  383   1HZ   LYS  52          HZ1       LYS  52  21.300  -4.762  12.948
  384   2HZ   LYS  52          HZ2       LYS  52  22.343  -5.359  14.148
  385   3HZ   LYS  52          HZ3       LYS  52  22.851  -4.106  13.128
  386    H    HIS  53           HN       HIS  53  16.314  -1.540  19.727
  387    HA   HIS  53           HA       HIS  53  15.575  -3.932  21.019
  388   1HB   HIS  53          HB2       HIS  53  15.629  -1.479  21.898
  389   2HB   HIS  53          HB1       HIS  53  13.976  -1.410  21.301
  390    HD1  HIS  53           HD1      HIS  53  12.294  -1.962  23.046
  391    HD2  HIS  53           HD2      HIS  53  15.910  -3.899  23.714
  392    HE1  HIS  53           HE1      HIS  53  12.031  -3.149  25.244
  393    HE2  HIS  53           HE2      HIS  53  14.296  -4.147  25.717
  394    H    ALA  54           HN       ALA  54  14.180  -2.264  18.329
  395    HA   ALA  54           HA       ALA  54  11.543  -3.333  18.592
  396   1HB   ALA  54          HB1       ALA  54  12.900  -2.206  16.148
  397   2HB   ALA  54          HB2       ALA  54  11.989  -1.277  17.340
  398   3HB   ALA  54          HB3       ALA  54  11.170  -2.484  16.347
  399    H    THR  55           HN       THR  55  14.428  -4.287  16.748
  400    HA   THR  55           HA       THR  55  13.074  -6.405  15.384
  401    HB   THR  55           HB       THR  55  15.381  -7.132  14.721
  402    HG1  THR  55           HG1      THR  55  16.767  -6.457  16.236
  403   1HG2  THR  55          HG21      THR  55  15.845  -5.154  13.324
  404   2HG2  THR  55          HG22      THR  55  14.696  -4.223  14.286
  405   3HG2  THR  55          HG23      THR  55  14.136  -5.588  13.319
  406    H    ARG  56           HN       ARG  56  15.197  -6.175  18.204
  407    HA   ARG  56           HA       ARG  56  15.337  -8.955  18.714
  408   1HB   ARG  56          HB2       ARG  56  15.528  -6.728  20.750
  409   2HB   ARG  56          HB1       ARG  56  16.163  -8.360  20.908
  410   1HG   ARG  56          HG2       ARG  56  17.566  -7.772  18.824
  411   2HG   ARG  56          HG1       ARG  56  17.167  -6.100  19.226
  412   1HD   ARG  56          HD2       ARG  56  19.261  -6.601  20.246
  413   2HD   ARG  56          HD1       ARG  56  18.050  -6.538  21.527
  414    HE   ARG  56           HE       ARG  56  18.302  -9.188  20.613
  415   1HH1  ARG  56          HH11      ARG  56  20.088  -6.792  22.445
  416   2HH1  ARG  56          HH12      ARG  56  20.977  -7.975  23.363
  417   1HH2  ARG  56          HH21      ARG  56  19.444 -10.740  21.817
  418   2HH2  ARG  56          HH22      ARG  56  20.601 -10.228  23.008
  419    H    HIS  57           HN       HIS  57  12.956  -6.538  19.319
  420    HA   HIS  57           HA       HIS  57  11.451  -7.775  21.333
  421   1HB   HIS  57          HB2       HIS  57  11.091  -5.450  20.675
  422   2HB   HIS  57          HB1       HIS  57  10.554  -5.963  19.080
  423    HD1  HIS  57           HD1      HIS  57   9.407  -5.803  22.666
  424    HD2  HIS  57           HD2      HIS  57   7.969  -6.864  18.913
  425    HE1  HIS  57           HE1      HIS  57   6.908  -6.105  22.917
  426    H    PHE  58           HN       PHE  58  11.354  -8.082  17.811
  427    HA   PHE  58           HA       PHE  58   9.118  -9.809  17.691
  428   1HB   PHE  58          HB2       PHE  58   9.779  -8.709  15.683
  429   2HB   PHE  58          HB1       PHE  58  11.423  -9.326  15.803
  430    HD1  PHE  58           HD1      PHE  58   7.992 -10.817  15.801
  431    HD2  PHE  58           HD2      PHE  58  11.934 -10.875  14.216
  432    HE1  PHE  58           HE1      PHE  58   7.380 -12.716  14.364
  433    HE2  PHE  58           HE2      PHE  58  11.330 -12.771  12.772
  434    HZ   PHE  58           HZ       PHE  58   9.051 -13.697  12.847
  435    H    HIS  59           HN       HIS  59  12.551 -10.337  18.102
  436    HA   HIS  59           HA       HIS  59  12.512 -13.152  17.812
  437   1HB   HIS  59          HB2       HIS  59  14.552 -11.746  17.629
  438   2HB   HIS  59          HB1       HIS  59  14.466 -11.432  19.358
  439    HD1  HIS  59           HD1      HIS  59  14.567 -14.542  17.149
  440    HD2  HIS  59           HD2      HIS  59  16.117 -13.062  20.716
  441    HE1  HIS  59           HE1      HIS  59  16.108 -16.333  18.020
  442    HE2  HIS  59           HE2      HIS  59  17.192 -15.322  20.063
  443    H    ALA  60           HN       ALA  60  11.749 -11.017  20.436
  444    HA   ALA  60           HA       ALA  60  11.818 -13.154  22.405
  445   1HB   ALA  60          HB1       ALA  60  12.648 -10.922  23.000
  446   2HB   ALA  60          HB2       ALA  60  11.309 -11.429  24.030
  447   3HB   ALA  60          HB3       ALA  60  11.033 -10.263  22.737
  448    H    THR  61           HN       THR  61   9.359 -10.825  21.232
  449    HA   THR  61           HA       THR  61   7.289 -12.283  22.639
  450    HB   THR  61           HB       THR  61   5.761 -10.533  21.670
  451    HG1  THR  61           HG1      THR  61   8.244  -9.505  20.707
  452   1HG2  THR  61          HG21      THR  61   6.778 -10.300  23.904
  453   2HG2  THR  61          HG22      THR  61   6.547  -8.742  23.109
  454   3HG2  THR  61          HG23      THR  61   8.155  -9.471  23.176
  455    H    GLY  62           HN       GLY  62   8.468 -12.080  19.369
  456   1HA   GLY  62          HA2       GLY  62   7.858 -13.359  17.529
  457   2HA   GLY  62          HA1       GLY  62   6.597 -14.101  18.507
  458    H    HIS  63           HN       HIS  63   7.117 -10.669  17.874
  459    HA   HIS  63           HA       HIS  63   4.442 -10.562  16.640
  460   1HB   HIS  63          HB2       HIS  63   5.959  -8.409  18.141
  461   2HB   HIS  63          HB1       HIS  63   4.411  -8.169  17.343
  462    HD2  HIS  63           HD2      HIS  63   3.817 -11.413  18.890
  463    HE1  HIS  63           HE1      HIS  63   3.128  -8.615  22.000
  464    HE2  HIS  63           HE2      HIS  63   3.002 -11.077  21.333
  465    HA   PRO  64           HA       PRO  64   7.277  -9.808  13.267
  466   1HB   PRO  64          HB2       PRO  64   5.759 -10.742  11.294
  467   2HB   PRO  64          HB1       PRO  64   6.410 -11.815  12.539
  468   1HG   PRO  64          HG2       PRO  64   3.654 -10.688  12.260
  469   2HG   PRO  64          HG1       PRO  64   4.153 -12.317  12.747
  470   1HD   PRO  64          HD2       PRO  64   3.431 -10.276  14.489
  471   2HD   PRO  64          HD1       PRO  64   4.384 -11.705  14.928
  472    H    ILE  65           HN       ILE  65   4.644  -7.839  13.906
  473    HA   ILE  65           HA       ILE  65   5.118  -6.349  11.413
  474    HB   ILE  65           HB       ILE  65   2.427  -6.791  12.704
  475   1HG1  ILE  65          HG12      ILE  65   3.549  -7.531   9.990
  476   2HG1  ILE  65          HG11      ILE  65   3.184  -8.643  11.304
  477   1HG2  ILE  65          HG21      ILE  65   2.615  -4.479  11.974
  478   2HG2  ILE  65          HG22      ILE  65   1.523  -5.372  10.916
  479   3HG2  ILE  65          HG23      ILE  65   3.164  -5.008  10.383
  480   1HD1  ILE  65          HD11      ILE  65   1.182  -6.987   9.786
  481   2HD1  ILE  65          HD12      ILE  65   0.814  -8.100  11.104
  482   3HD1  ILE  65          HD13      ILE  65   1.475  -8.715   9.588
  483    H    ILE  66           HN       ILE  66   5.586  -4.299  11.594
  484    HA   ILE  66           HA       ILE  66   4.899  -2.824  14.047
  485    HB   ILE  66           HB       ILE  66   7.141  -1.740  13.977
  486   1HG1  ILE  66          HG12      ILE  66   7.813  -3.960  12.029
  487   2HG1  ILE  66          HG11      ILE  66   7.616  -2.266  11.595
  488   1HG2  ILE  66          HG21      ILE  66   6.678  -3.562  15.542
  489   2HG2  ILE  66          HG22      ILE  66   8.361  -3.575  15.016
  490   3HG2  ILE  66          HG23      ILE  66   7.216  -4.732  14.336
  491   1HD1  ILE  66          HD11      ILE  66   9.710  -3.375  13.448
  492   2HD1  ILE  66          HD12      ILE  66   9.524  -1.683  12.986
  493   3HD1  ILE  66          HD13      ILE  66   9.957  -2.886  11.772
  494    H    GLU  67           HN       GLU  67   4.710  -0.547  13.749
  495    HA   GLU  67           HA       GLU  67   4.675   0.352  10.944
  496   1HB   GLU  67          HB2       GLU  67   3.236   1.326  13.394
  497   2HB   GLU  67          HB1       GLU  67   3.470   2.385  12.015
  498   1HG   GLU  67          HG2       GLU  67   2.327   0.641  10.621
  499   2HG   GLU  67          HG1       GLU  67   1.920  -0.180  12.130
  500    H    GLY  68           HN       GLY  68   5.369   2.617  10.605
  501   1HA   GLY  68          HA2       GLY  68   7.786   3.225  12.093
  502   2HA   GLY  68          HA1       GLY  68   7.171   4.098  10.692
  503    H    TYR  69           HN       TYR  69   7.347   3.989  14.100
  504    HA   TYR  69           HA       TYR  69   5.111   5.758  14.551
  505   1HB   TYR  69          HB2       TYR  69   5.851   3.977  16.178
  506   2HB   TYR  69          HB1       TYR  69   7.274   4.957  16.509
  507    HD1  TYR  69           HD1      TYR  69   7.133   5.980  18.561
  508    HD2  TYR  69           HD2      TYR  69   3.613   5.698  16.190
  509    HE1  TYR  69           HE1      TYR  69   5.886   7.223  20.274
  510    HE2  TYR  69           HE2      TYR  69   2.356   6.941  17.899
  511    HH   TYR  69           HH       TYR  69   3.948   8.496  20.566
  512    H    ASP  70           HN       ASP  70   8.479   6.006  13.938
  513    HA   ASP  70           HA       ASP  70   8.747   8.717  14.832
  514   1HB   ASP  70          HB2       ASP  70  10.781   7.583  14.849
  515   2HB   ASP  70          HB1       ASP  70  10.505   6.844  13.280
  516    HA   PRO  71           HA       PRO  71   7.747   9.873  10.399
  517   1HB   PRO  71          HB2       PRO  71   7.878   8.148   8.353
  518   2HB   PRO  71          HB1       PRO  71   9.333   8.870   9.046
  519   1HG   PRO  71          HG2       PRO  71   8.312   6.111   9.274
  520   2HG   PRO  71          HG1       PRO  71   9.968   6.715   9.433
  521   1HD   PRO  71          HD2       PRO  71   8.100   6.086  11.523
  522   2HD   PRO  71          HD1       PRO  71   9.760   6.684  11.679
  523    HA   PRO  72           HA       PRO  72   3.584   8.083  11.095
  524   1HB   PRO  72          HB2       PRO  72   2.658  10.832  10.803
  525   2HB   PRO  72          HB1       PRO  72   2.578   9.777  12.216
  526   1HG   PRO  72          HG2       PRO  72   4.186  11.950  12.112
  527   2HG   PRO  72          HG1       PRO  72   4.607  10.490  13.027
  528   1HD   PRO  72          HD2       PRO  72   5.546  11.359  10.313
  529   2HD   PRO  72          HD1       PRO  72   6.481  10.673  11.661
  530    H    GLU  73           HN       GLU  73   4.648   7.772   8.607
  531    HA   GLU  73           HA       GLU  73   3.064   9.219   6.654
  532   1HB   GLU  73          HB2       GLU  73   4.967   6.921   6.198
  533   2HB   GLU  73          HB1       GLU  73   4.407   8.093   5.012
  534   1HG   GLU  73          HG2       GLU  73   5.600   9.863   6.153
  535   2HG   GLU  73          HG1       GLU  73   6.111   8.735   7.408
  536    H    GLY  74           HN       GLY  74   3.016   6.219   8.344
  537   1HA   GLY  74          HA2       GLY  74   1.139   4.833   8.553
  538   2HA   GLY  74          HA1       GLY  74   0.459   5.575   7.113
  539    H    TRP  75           HN       TRP  75   2.999   3.370   8.210
  540    HA   TRP  75           HA       TRP  75   2.384   1.602   6.019
  541   1HB   TRP  75          HB2       TRP  75   4.809   1.399   5.350
  542   2HB   TRP  75          HB1       TRP  75   4.020   2.893   4.867
  543    HD1  TRP  75           HD1      TRP  75   4.895   5.146   5.941
  544    HE1  TRP  75           HE1      TRP  75   7.042   5.748   7.222
  545    HE3  TRP  75           HE3      TRP  75   6.500   0.427   7.081
  546    HZ2  TRP  75           HZ2      TRP  75   9.136   4.395   8.552
  547    HZ3  TRP  75           HZ3      TRP  75   8.585   0.169   8.361
  548    HH2  TRP  75           HH2      TRP  75   9.874   2.113   9.080
  549    H    GLY  76           HN       GLY  76   2.992  -0.511   6.380
  550   1HA   GLY  76          HA2       GLY  76   3.974  -1.026   9.119
  551   2HA   GLY  76          HA1       GLY  76   2.746  -2.000   8.323
  552    H    TRP  77           HN       TRP  77   5.624  -2.353   9.403
  553    HA   TRP  77           HA       TRP  77   6.758  -3.638   7.010
  554   1HB   TRP  77          HB2       TRP  77   8.211  -1.947   8.008
  555   2HB   TRP  77          HB1       TRP  77   8.090  -2.736   9.574
  556    HD1  TRP  77           HD1      TRP  77   9.860  -4.542  10.111
  557    HE1  TRP  77           HE1      TRP  77  11.778  -5.658   8.799
  558    HE3  TRP  77           HE3      TRP  77   8.786  -2.757   5.440
  559    HZ2  TRP  77           HZ2      TRP  77  12.697  -5.771   6.136
  560    HZ3  TRP  77           HZ3      TRP  77  10.234  -3.419   3.565
  561    HH2  TRP  77           HH2      TRP  77  12.149  -4.895   3.908
  562    H    CYS  78           HN       CYS  78   6.968  -5.791   6.962
  563    HA   CYS  78           HA       CYS  78   6.282  -7.268   9.422
  564   1HB   CYS  78          HB2       CYS  78   4.760  -7.407   7.341
  565   2HB   CYS  78          HB1       CYS  78   6.046  -8.367   6.626
  566    H    TYR  79           HN       TYR  79   7.969  -8.225  10.330
  567    HA   TYR  79           HA       TYR  79  10.550  -8.091   9.361
  568   1HB   TYR  79          HB2       TYR  79   9.347  -9.884  11.458
  569   2HB   TYR  79          HB1       TYR  79  11.075  -9.829  11.132
  570    HD1  TYR  79           HD1      TYR  79  12.170  -7.463  11.238
  571    HD2  TYR  79           HD2      TYR  79   8.444  -8.443  13.039
  572    HE1  TYR  79           HE1      TYR  79  12.420  -5.563  12.775
  573    HE2  TYR  79           HE2      TYR  79   8.683  -6.541  14.580
  574    HH   TYR  79           HH       TYR  79  10.616  -5.198  15.544
  575    H    VAL  80           HN       VAL  80   8.615 -11.100   9.547
  576    HA   VAL  80           HA       VAL  80  10.643 -12.631   8.293
  577    HB   VAL  80           HB       VAL  80   8.863 -14.406   8.092
  578   1HG1  VAL  80          HG11      VAL  80  10.372 -14.290   9.996
  579   2HG1  VAL  80          HG12      VAL  80   8.766 -14.808  10.506
  580   3HG1  VAL  80          HG13      VAL  80   9.292 -13.151  10.801
  581   1HG2  VAL  80          HG21      VAL  80   6.766 -14.039   9.311
  582   2HG2  VAL  80          HG22      VAL  80   6.910 -12.959   7.923
  583   3HG2  VAL  80          HG23      VAL  80   7.205 -12.348   9.551
  584    H    ASP  81           HN       ASP  81   7.958 -10.821   7.056
  585    HA   ASP  81           HA       ASP  81   7.951 -12.085   4.463
  586   1HB   ASP  81          HB2       ASP  81   6.710  -9.465   5.334
  587   2HB   ASP  81          HB1       ASP  81   6.394 -10.296   3.819
  588    H    GLU  82           HN       GLU  82   9.261  -9.216   5.955
  589    HA   GLU  82           HA       GLU  82  10.661  -7.579   5.295
  590   1HB   GLU  82          HB2       GLU  82  11.447  -9.499   3.092
  591   2HB   GLU  82          HB1       GLU  82  12.353  -8.076   3.598
  592   1HG   GLU  82          HG2       GLU  82  12.560  -9.101   5.857
  593   2HG   GLU  82          HG1       GLU  82  11.821 -10.561   5.204
  594    H    VAL  83           HN       VAL  83   7.956  -7.740   4.354
  595    HA   VAL  83           HA       VAL  83   8.181  -6.083   1.934
  596    HB   VAL  83           HB       VAL  83   5.875  -6.597   1.396
  597   1HG1  VAL  83          HG11      VAL  83   7.464  -9.090   1.971
  598   2HG1  VAL  83          HG12      VAL  83   7.531  -8.106   0.509
  599   3HG1  VAL  83          HG13      VAL  83   6.063  -9.000   0.904
  600   1HG2  VAL  83          HG21      VAL  83   5.845  -8.323   3.875
  601   2HG2  VAL  83          HG22      VAL  83   4.559  -8.240   2.669
  602   3HG2  VAL  83          HG23      VAL  83   4.953  -6.820   3.638
  603    H    MET  84           HN       MET  84   6.893  -4.184   1.846
  604    HA   MET  84           HA       MET  84   6.082  -3.194   4.503
  605   1HB   MET  84          HB2       MET  84   8.080  -2.039   3.579
  606   2HB   MET  84          HB1       MET  84   7.134  -1.576   2.171
  607   1HG   MET  84          HG2       MET  84   5.598  -0.340   3.674
  608   2HG   MET  84          HG1       MET  84   6.673  -0.719   5.018
  609   1HE   MET  84          HE1       MET  84   9.190   0.141   5.178
  610   2HE   MET  84          HE2       MET  84   9.953   1.164   3.961
  611   3HE   MET  84          HE3       MET  84   9.535  -0.505   3.574
  612    H    PHE  85           HN       PHE  85   3.950  -3.085   4.640
  613    HA   PHE  85           HA       PHE  85   2.439  -2.586   2.173
  614   1HB   PHE  85          HB2       PHE  85   0.480  -3.525   3.480
  615   2HB   PHE  85          HB1       PHE  85   1.744  -4.663   3.041
  616    HD1  PHE  85           HD1      PHE  85   0.135  -2.865   5.788
  617    HD2  PHE  85           HD2      PHE  85   3.122  -5.698   4.714
  618    HE1  PHE  85           HE1      PHE  85   0.294  -3.582   8.132
  619    HE2  PHE  85           HE2      PHE  85   3.289  -6.418   7.059
  620    HZ   PHE  85           HZ       PHE  85   1.875  -5.357   8.773
  621    H    ASP  86           HN       ASP  86   0.634  -1.186   2.230
  622    HA   ASP  86           HA       ASP  86   1.256   1.197   3.695
  623   1HB   ASP  86          HB2       ASP  86   0.420   1.199   1.333
  624   2HB   ASP  86          HB1       ASP  86  -1.148   0.670   1.937
  625    H    LEU  87           HN       LEU  87   0.545   1.707   5.619
  626    HA   LEU  87           HA       LEU  87  -2.015   0.580   6.528
  627   1HB   LEU  87          HB2       LEU  87   0.530   1.104   8.028
  628   2HB   LEU  87          HB1       LEU  87  -1.008   1.077   8.867
  629    HG   LEU  87           HG       LEU  87   0.205  -1.210   7.314
  630   1HD1  LEU  87          HD11      LEU  87   0.350  -2.281   9.510
  631   2HD1  LEU  87          HD12      LEU  87  -0.258  -0.808  10.266
  632   3HD1  LEU  87          HD13      LEU  87   1.304  -0.799   9.447
  633   1HD2  LEU  87          HD21      LEU  87  -2.224  -1.201   7.114
  634   2HD2  LEU  87          HD22      LEU  87  -2.377  -1.051   8.865
  635   3HD2  LEU  87          HD23      LEU  87  -1.686  -2.514   8.162
  636    H    SER  88           HN       SER  88  -1.361   3.115   5.057
  637    HA   SER  88           HA       SER  88  -1.468   5.307   6.834
  638   1HB   SER  88          HB2       SER  88  -0.798   5.417   4.422
  639   2HB   SER  88          HB1       SER  88  -2.491   5.198   3.986
  640    HG   SER  88           HG       SER  88  -1.435   7.446   4.260
  641    H    ASP  89           HN       ASP  89  -3.889   3.220   5.493
  642    HA   ASP  89           HA       ASP  89  -6.165   4.805   6.136
  643   1HB   ASP  89          HB2       ASP  89  -6.297   3.109   4.417
  644   2HB   ASP  89          HB1       ASP  89  -5.835   1.854   5.559
  645    H    ARG  90           HN       ARG  90  -4.070   2.849   8.019
  646    HA   ARG  90           HA       ARG  90  -6.022   2.795  10.229
  647   1HB   ARG  90          HB2       ARG  90  -4.139   0.508   9.652
  648   2HB   ARG  90          HB1       ARG  90  -5.496   0.537  10.767
  649   1HG   ARG  90          HG2       ARG  90  -7.053   0.609   8.913
  650   2HG   ARG  90          HG1       ARG  90  -5.711   0.665   7.767
  651   1HD   ARG  90          HD2       ARG  90  -4.945  -1.528   8.691
  652   2HD   ARG  90          HD1       ARG  90  -6.434  -1.586   9.634
  653    HE   ARG  90           HE       ARG  90  -6.730  -1.245   6.755
  654   1HH1  ARG  90          HH11      ARG  90  -6.847  -3.388   9.527
  655   2HH1  ARG  90          HH12      ARG  90  -7.645  -4.673   8.663
  656   1HH2  ARG  90          HH21      ARG  90  -7.787  -2.900   5.625
  657   2HH2  ARG  90          HH22      ARG  90  -8.172  -4.396   6.425
  658    H    MET  91           HN       MET  91  -3.670   4.514   9.615
  659    HA   MET  91           HA       MET  91  -1.329   3.556  10.850
  660   1HB   MET  91          HB2       MET  91  -0.444   5.780  10.607
  661   2HB   MET  91          HB1       MET  91  -1.387   5.392   9.175
  662   1HG   MET  91          HG2       MET  91  -3.201   6.759   9.917
  663   2HG   MET  91          HG1       MET  91  -2.437   7.008  11.485
  664   1HE   MET  91          HE1       MET  91  -2.284   7.747   7.652
  665   2HE   MET  91          HE2       MET  91  -0.680   7.069   7.931
  666   3HE   MET  91          HE3       MET  91  -0.857   8.775   7.522
  667    H    THR  92           HN       THR  92  -0.368   3.956  12.809
  668    HA   THR  92           HA       THR  92  -2.113   4.984  14.927
  669    HB   THR  92           HB       THR  92   0.605   3.742  15.339
  670    HG1  THR  92           HG1      THR  92  -0.520   2.162  14.255
  671   1HG2  THR  92          HG21      THR  92  -0.343   3.171  17.533
  672   2HG2  THR  92          HG22      THR  92  -1.857   3.954  17.077
  673   3HG2  THR  92          HG23      THR  92  -0.385   4.911  17.242
  674    HA   PRO  93           HA       PRO  93   0.330   8.741  14.332
  675   1HB   PRO  93          HB2       PRO  93  -1.654   9.994  16.056
  676   2HB   PRO  93          HB1       PRO  93  -1.321  10.290  14.349
  677   1HG   PRO  93          HG2       PRO  93  -3.599   9.103  15.214
  678   2HG   PRO  93          HG1       PRO  93  -2.859   8.739  13.644
  679   1HD   PRO  93          HD2       PRO  93  -2.720   7.194  16.209
  680   2HD   PRO  93          HD1       PRO  93  -2.941   6.602  14.547
  681    H    HIS  94           HN       HIS  94   1.457  10.224  15.736
  682    HA   HIS  94           HA       HIS  94   2.483   9.022  18.078
  683   1HB   HIS  94          HB2       HIS  94   3.770  11.036  18.406
  684   2HB   HIS  94          HB1       HIS  94   3.752  10.664  16.690
  685    HD1  HIS  94           HD1      HIS  94   2.062  12.208  15.220
  686    HD2  HIS  94           HD2      HIS  94   2.984  13.560  19.045
  687    HE1  HIS  94           HE1      HIS  94   1.447  14.643  15.246
  688    HE2  HIS  94           HE2      HIS  94   2.203  15.482  17.497
  689    H    ASN  95           HN       ASN  95   1.749   9.002  20.103
  690    HA   ASN  95           HA       ASN  95  -0.798  10.258  20.610
  691   1HB   ASN  95          HB2       ASN  95  -0.991   8.885  22.493
  692   2HB   ASN  95          HB1       ASN  95  -0.071   7.901  21.363
  693   1HD2  ASN  95          HD21      ASN  95   2.080   7.434  21.805
  694   2HD2  ASN  95          HD22      ASN  95   2.778   7.714  23.365
  695    H    GLY  96           HN       GLY  96   2.415  11.155  21.058
  696   1HA   GLY  96          HA2       GLY  96   1.658  13.519  22.494
  697   2HA   GLY  96          HA1       GLY  96   2.603  12.404  23.471
  698    HA   PRO  97           HA       PRO  97   5.406  15.249  21.011
  699   1HB   PRO  97          HB2       PRO  97   6.672  15.774  23.595
  700   2HB   PRO  97          HB1       PRO  97   5.994  16.915  22.432
  701   1HG   PRO  97          HG2       PRO  97   4.833  16.417  24.821
  702   2HG   PRO  97          HG1       PRO  97   3.899  16.837  23.373
  703   1HD   PRO  97          HD2       PRO  97   4.360  14.156  24.624
  704   2HD   PRO  97          HD1       PRO  97   2.877  14.830  23.913
  705    H    ILE  98           HN       ILE  98   6.949  14.136  20.019
  706    HA   ILE  98           HA       ILE  98   8.626  12.302  21.607
  707    HB   ILE  98           HB       ILE  98   8.166  12.315  18.618
  708   1HG1  ILE  98          HG12      ILE  98   7.116  10.431  20.742
  709   2HG1  ILE  98          HG11      ILE  98   6.161  11.638  19.886
  710   1HG2  ILE  98          HG21      ILE  98   9.337  10.167  18.643
  711   2HG2  ILE  98          HG22      ILE  98   9.617  10.339  20.375
  712   3HG2  ILE  98          HG23      ILE  98  10.367  11.466  19.245
  713   1HD1  ILE  98          HD11      ILE  98   6.586  10.472  17.782
  714   2HD1  ILE  98          HD12      ILE  98   5.798   9.431  18.968
  715   3HD1  ILE  98          HD13      ILE  98   7.524   9.259  18.654
  716    HA   PRO  99           HA       PRO  99  11.881  15.292  20.856
  717   1HB   PRO  99          HB2       PRO  99  13.901  13.790  21.915
  718   2HB   PRO  99          HB1       PRO  99  12.775  14.740  22.891
  719   1HG   PRO  99          HG2       PRO  99  12.770  11.812  22.298
  720   2HG   PRO  99          HG1       PRO  99  12.405  12.650  23.817
  721   1HD   PRO  99          HD2       PRO  99  10.478  11.681  22.173
  722   2HD   PRO  99          HD1       PRO  99  10.244  13.123  23.182
  723    H    ARG 100           HN       ARG 100  12.413  15.472  18.781
  724    HA   ARG 100           HA       ARG 100  13.285  13.181  17.231
  725   1HB   ARG 100          HB2       ARG 100  11.714  14.903  16.339
  726   2HB   ARG 100          HB1       ARG 100  13.002  16.089  16.435
  727   1HG   ARG 100          HG2       ARG 100  13.304  13.601  14.796
  728   2HG   ARG 100          HG1       ARG 100  12.471  15.021  14.168
  729   1HD   ARG 100          HD2       ARG 100  15.333  14.830  15.093
  730   2HD   ARG 100          HD1       ARG 100  14.754  15.093  13.448
  731    HE   ARG 100           HE       ARG 100  13.848  17.129  15.240
  732   1HH1  ARG 100          HH11      ARG 100  16.560  16.076  13.276
  733   2HH1  ARG 100          HH12      ARG 100  17.280  17.660  13.209
  734   1HH2  ARG 100          HH21      ARG 100  14.797  19.207  15.146
  735   2HH2  ARG 100          HH22      ARG 100  16.287  19.434  14.278
  736    H    TYR 101           HN       TYR 101  15.345  12.596  17.066
  737    HA   TYR 101           HA       TYR 101  17.414  14.496  17.887
  738   1HB   TYR 101          HB2       TYR 101  17.456  11.489  17.599
  739   2HB   TYR 101          HB1       TYR 101  18.885  12.449  17.967
  740    HD1  TYR 101           HD1      TYR 101  19.132  13.531  20.139
  741    HD2  TYR 101           HD2      TYR 101  15.724  11.143  19.260
  742    HE1  TYR 101           HE1      TYR 101  18.579  13.450  22.533
  743    HE2  TYR 101           HE2      TYR 101  15.161  11.057  21.651
  744    HH   TYR 101           HH       TYR 101  16.698  13.064  23.974
  745    H    VAL 102           HN       VAL 102  16.595  12.308  15.217
  746    HA   VAL 102           HA       VAL 102  18.738  13.558  13.650
  747    HB   VAL 102           HB       VAL 102  18.485  11.554  12.118
  748   1HG1  VAL 102          HG11      VAL 102  19.372  11.058  14.960
  749   2HG1  VAL 102          HG12      VAL 102  20.339  11.801  13.686
  750   3HG1  VAL 102          HG13      VAL 102  19.848  10.113  13.550
  751   1HG2  VAL 102          HG21      VAL 102  17.501   9.530  13.086
  752   2HG2  VAL 102          HG22      VAL 102  16.290  10.796  12.876
  753   3HG2  VAL 102          HG23      VAL 102  16.949  10.462  14.478
  Start of MODEL    9
    1   1H    MET   1          HT1       MET   1   4.315   1.033  -2.496
    2   2H    MET   1          HT2       MET   1   5.729   0.374  -1.831
    3   3H    MET   1          HT3       MET   1   4.940   1.652  -1.044
    4    HA   MET   1           HA       MET   1   4.556  -0.507   0.021
    5   1HB   MET   1          HB2       MET   1   2.148  -0.238   0.266
    6   2HB   MET   1          HB1       MET   1   2.929   1.337   0.234
    7   1HG   MET   1          HG2       MET   1   2.293   1.593  -2.119
    8   2HG   MET   1          HG1       MET   1   1.486   0.029  -2.061
    9   1HE   MET   1          HE1       MET   1  -0.767   1.073  -2.952
   10   2HE   MET   1          HE2       MET   1   0.025   2.644  -3.069
   11   3HE   MET   1          HE3       MET   1  -1.531   2.501  -2.252
   12    H    THR   2           HN       THR   2   3.085  -2.429  -0.070
   13    HA   THR   2           HA       THR   2   2.605  -3.404  -2.790
   14    HB   THR   2           HB       THR   2   4.791  -4.311  -2.049
   15    HG1  THR   2           HG1      THR   2   3.270  -5.566  -3.383
   16   1HG2  THR   2          HG21      THR   2   4.407  -4.363   0.354
   17   2HG2  THR   2          HG22      THR   2   4.869  -5.959  -0.237
   18   3HG2  THR   2          HG23      THR   2   3.182  -5.616   0.147
   19    H    MET   3           HN       MET   3   1.491  -5.742  -2.434
   20    HA   MET   3           HA       MET   3  -1.040  -5.239  -1.301
   21   1HB   MET   3          HB2       MET   3  -0.628  -6.821  -3.160
   22   2HB   MET   3          HB1       MET   3   0.224  -7.884  -2.051
   23   1HG   MET   3          HG2       MET   3  -1.848  -8.155  -0.754
   24   2HG   MET   3          HG1       MET   3  -2.690  -7.142  -1.926
   25   1HE   MET   3          HE1       MET   3  -0.969 -10.576  -1.227
   26   2HE   MET   3          HE2       MET   3   0.076  -9.903  -2.479
   27   3HE   MET   3          HE3       MET   3  -0.928 -11.309  -2.831
   28    H    GLY   4           HN       GLY   4  -1.959  -5.843   0.618
   29   1HA   GLY   4          HA2       GLY   4  -0.258  -6.275   2.853
   30   2HA   GLY   4          HA1       GLY   4  -2.015  -6.339   2.862
   31    H    CYS   5           HN       CYS   5  -0.266  -8.079   4.311
   32    HA   CYS   5           HA       CYS   5  -0.731 -10.622   2.908
   33   1HB   CYS   5          HB2       CYS   5   1.076 -11.588   4.171
   34   2HB   CYS   5          HB1       CYS   5   1.652 -10.100   3.434
   35    H    ARG   6           HN       ARG   6  -1.375 -12.457   4.279
   36    HA   ARG   6           HA       ARG   6  -3.743 -11.890   5.606
   37   1HB   ARG   6          HB2       ARG   6  -3.829 -14.215   6.208
   38   2HB   ARG   6          HB1       ARG   6  -3.133 -14.077   4.601
   39   1HG   ARG   6          HG2       ARG   6  -0.869 -14.251   5.701
   40   2HG   ARG   6          HG1       ARG   6  -1.724 -14.690   7.181
   41   1HD   ARG   6          HD2       ARG   6  -2.806 -16.546   5.921
   42   2HD   ARG   6          HD1       ARG   6  -1.781 -16.145   4.543
   43    HE   ARG   6           HE       ARG   6  -0.544 -16.822   7.112
   44   1HH1  ARG   6          HH11      ARG   6  -1.109 -17.547   3.730
   45   2HH1  ARG   6          HH12      ARG   6   0.072 -18.822   3.680
   46   1HH2  ARG   6          HH21      ARG   6   0.999 -18.507   7.045
   47   2HH2  ARG   6          HH22      ARG   6   1.240 -19.389   5.571
   48    H    HIS   7           HN       HIS   7  -0.536 -11.893   6.880
   49    HA   HIS   7           HA       HIS   7  -1.029 -12.268   9.599
   50   1HB   HIS   7          HB2       HIS   7   1.065 -10.588   8.214
   51   2HB   HIS   7          HB1       HIS   7   1.056 -10.904   9.947
   52    HD2  HIS   7           HD2      HIS   7   0.477 -14.078   9.938
   53    HE1  HIS   7           HE1      HIS   7   3.830 -14.280   7.372
   54    HE2  HIS   7           HE2      HIS   7   2.198 -15.626   8.767
   55    H    VAL   8           HN       VAL   8  -1.775  -9.567   7.560
   56    HA   VAL   8           HA       VAL   8  -1.988  -7.523   9.467
   57    HB   VAL   8           HB       VAL   8  -2.112  -7.155   7.012
   58   1HG1  VAL   8          HG11      VAL   8  -3.597  -8.966   6.421
   59   2HG1  VAL   8          HG12      VAL   8  -4.238  -7.421   5.864
   60   3HG1  VAL   8          HG13      VAL   8  -4.914  -8.192   7.298
   61   1HG2  VAL   8          HG21      VAL   8  -3.949  -5.438   7.087
   62   2HG2  VAL   8          HG22      VAL   8  -2.745  -5.314   8.363
   63   3HG2  VAL   8          HG23      VAL   8  -4.322  -6.020   8.710
   64    H    ALA   9           HN       ALA   9  -4.057 -10.249   8.808
   65    HA   ALA   9           HA       ALA   9  -6.377  -9.266  10.131
   66   1HB   ALA   9          HB1       ALA   9  -6.495 -11.090   8.523
   67   2HB   ALA   9          HB2       ALA   9  -7.143 -11.585  10.087
   68   3HB   ALA   9          HB3       ALA   9  -5.533 -12.109   9.594
   69    H    GLY  10           HN       GLY  10  -3.366 -10.247  11.303
   70   1HA   GLY  10          HA2       GLY  10  -4.426 -11.053  13.914
   71   2HA   GLY  10          HA1       GLY  10  -2.745 -11.144  13.405
   72    H    ILE  11           HN       ILE  11  -2.803  -8.406  12.340
   73    HA   ILE  11           HA       ILE  11  -2.137  -7.071  14.818
   74    HB   ILE  11           HB       ILE  11  -1.392  -5.214  13.334
   75   1HG1  ILE  11          HG12      ILE  11  -2.297  -7.132  11.181
   76   2HG1  ILE  11          HG11      ILE  11  -2.939  -5.529  11.499
   77   1HG2  ILE  11          HG21      ILE  11  -0.314  -7.961  12.712
   78   2HG2  ILE  11          HG22      ILE  11   0.181  -6.909  14.038
   79   3HG2  ILE  11          HG23      ILE  11   0.520  -6.446  12.370
   80   1HD1  ILE  11          HD11      ILE  11  -0.978  -4.492  10.680
   81   2HD1  ILE  11          HD12      ILE  11  -1.443  -5.739   9.512
   82   3HD1  ILE  11          HD13      ILE  11  -0.114  -6.029  10.636
   83    H    ARG  12           HN       ARG  12  -3.038  -5.135  15.539
   84    HA   ARG  12           HA       ARG  12  -5.537  -4.305  14.262
   85   1HB   ARG  12          HB2       ARG  12  -6.732  -4.226  16.354
   86   2HB   ARG  12          HB1       ARG  12  -6.116  -5.847  16.110
   87   1HG   ARG  12          HG2       ARG  12  -4.819  -3.797  17.890
   88   2HG   ARG  12          HG1       ARG  12  -5.968  -5.010  18.444
   89   1HD   ARG  12          HD2       ARG  12  -3.218  -5.428  17.309
   90   2HD   ARG  12          HD1       ARG  12  -3.804  -5.848  18.916
   91    HE   ARG  12           HE       ARG  12  -4.178  -7.346  16.460
   92   1HH1  ARG  12          HH11      ARG  12  -5.228  -6.913  19.782
   93   2HH1  ARG  12          HH12      ARG  12  -5.791  -8.546  19.930
   94   1HH2  ARG  12          HH21      ARG  12  -4.924  -9.480  16.676
   95   2HH2  ARG  12          HH22      ARG  12  -5.637  -9.993  18.179
   96    H    THR  13           HN       THR  13  -6.348  -2.234  15.572
   97    HA   THR  13           HA       THR  13  -4.229  -0.310  15.472
   98    HB   THR  13           HB       THR  13  -7.012   0.085  16.586
   99    HG1  THR  13           HG1      THR  13  -7.537   0.719  14.427
  100   1HG2  THR  13          HG21      THR  13  -5.010   2.000  15.373
  101   2HG2  THR  13          HG22      THR  13  -5.455   1.901  17.077
  102   3HG2  THR  13          HG23      THR  13  -6.645   2.420  15.884
  103    H    VAL  14           HN       VAL  14  -2.759  -0.237  17.030
  104    HA   VAL  14           HA       VAL  14  -3.509  -1.158  19.707
  105    HB   VAL  14           HB       VAL  14  -1.047  -1.411  20.066
  106   1HG1  VAL  14          HG11      VAL  14  -2.237  -2.920  17.743
  107   2HG1  VAL  14          HG12      VAL  14  -2.419  -3.314  19.452
  108   3HG1  VAL  14          HG13      VAL  14  -0.835  -3.430  18.686
  109   1HG2  VAL  14          HG21      VAL  14   0.413  -1.411  18.081
  110   2HG2  VAL  14          HG22      VAL  14  -0.243   0.189  18.426
  111   3HG2  VAL  14          HG23      VAL  14  -0.922  -0.778  17.117
  112    H    THR  15           HN       THR  15  -2.543  -0.115  21.552
  113    HA   THR  15           HA       THR  15  -2.407   2.782  21.236
  114    HB   THR  15           HB       THR  15  -2.501   1.135  23.772
  115    HG1  THR  15           HG1      THR  15  -4.669   2.586  22.640
  116   1HG2  THR  15          HG21      THR  15  -2.995   4.077  23.287
  117   2HG2  THR  15          HG22      THR  15  -1.600   3.380  24.109
  118   3HG2  THR  15          HG23      THR  15  -3.205   3.240  24.826
  119    HA   PRO  16           HA       PRO  16   2.074   2.590  21.553
  120   1HB   PRO  16          HB2       PRO  16   2.356   5.288  22.090
  121   2HB   PRO  16          HB1       PRO  16   2.271   4.588  20.470
  122   1HG   PRO  16          HG2       PRO  16   0.135   5.910  22.082
  123   2HG   PRO  16          HG1       PRO  16   0.447   6.001  20.339
  124   1HD   PRO  16          HD2       PRO  16  -1.530   4.484  21.361
  125   2HD   PRO  16          HD1       PRO  16  -0.619   3.996  19.917
  126    H    SER  17           HN       SER  17   2.799   1.682  23.359
  127    HA   SER  17           HA       SER  17   1.847   2.396  25.959
  128   1HB   SER  17          HB2       SER  17   3.799   0.738  26.577
  129   2HB   SER  17          HB1       SER  17   2.329   0.138  25.807
  130    HG   SER  17           HG       SER  17   3.379  -0.108  23.931
  131    H    ALA  18           HN       ALA  18   4.187   3.702  23.965
  132    HA   ALA  18           HA       ALA  18   5.201   5.372  26.083
  133   1HB   ALA  18          HB1       ALA  18   6.740   3.500  26.258
  134   2HB   ALA  18          HB2       ALA  18   7.572   4.903  25.587
  135   3HB   ALA  18          HB3       ALA  18   7.073   3.584  24.529
  136    H    LEU  19           HN       LEU  19   6.189   7.275  25.282
  137    HA   LEU  19           HA       LEU  19   5.447   7.980  22.588
  138   1HB   LEU  19          HB2       LEU  19   6.811   9.440  24.834
  139   2HB   LEU  19          HB1       LEU  19   6.787  10.118  23.219
  140    HG   LEU  19           HG       LEU  19   5.026  11.124  24.485
  141   1HD1  LEU  19          HD11      LEU  19   4.516  10.681  22.164
  142   2HD1  LEU  19          HD12      LEU  19   3.064  10.517  23.151
  143   3HD1  LEU  19          HD13      LEU  19   3.908   9.078  22.579
  144   1HD2  LEU  19          HD21      LEU  19   3.219   9.840  25.503
  145   2HD2  LEU  19          HD22      LEU  19   4.778   9.423  26.215
  146   3HD2  LEU  19          HD23      LEU  19   4.023   8.337  25.049
  147    H    GLY  20           HN       GLY  20   8.457   7.525  24.371
  148   1HA   GLY  20          HA2       GLY  20   9.891   7.412  21.803
  149   2HA   GLY  20          HA1       GLY  20  10.635   7.780  23.354
  150    H    CYS  21           HN       CYS  21  12.132   6.053  22.601
  151    HA   CYS  21           HA       CYS  21  11.163   3.351  22.649
  152   1HB   CYS  21          HB2       CYS  21  13.110   3.940  21.285
  153   2HB   CYS  21          HB1       CYS  21  13.989   4.434  22.727
  154    HG   CYS  21           HG       CYS  21  15.216   2.142  22.501
  155    H    GLU  22           HN       GLU  22  10.239   2.888  24.603
  156    HA   GLU  22           HA       GLU  22  11.398   3.509  27.106
  157   1HB   GLU  22          HB2       GLU  22   9.000   2.883  26.784
  158   2HB   GLU  22          HB1       GLU  22   9.515   1.227  26.483
  159   1HG   GLU  22          HG2       GLU  22   8.780   1.402  28.747
  160   2HG   GLU  22          HG1       GLU  22  10.530   1.180  28.738
  161    H    GLU  23           HN       GLU  23  13.468   2.984  27.157
  162    HA   GLU  23           HA       GLU  23  14.535   0.607  27.935
  163   1HB   GLU  23          HB2       GLU  23  13.752  -0.285  25.719
  164   2HB   GLU  23          HB1       GLU  23  14.784   0.893  24.923
  165   1HG   GLU  23          HG2       GLU  23  15.827  -1.280  24.942
  166   2HG   GLU  23          HG1       GLU  23  16.749  -0.146  25.928
  167    H    CYS  24           HN       CYS  24  15.385   2.702  25.204
  168    HA   CYS  24           HA       CYS  24  17.943   3.388  26.185
  169   1HB   CYS  24          HB2       CYS  24  16.241   4.919  24.205
  170   2HB   CYS  24          HB1       CYS  24  17.991   5.007  24.379
  171    HG   CYS  24           HG       CYS  24  18.345   3.364  22.441
  172    H    LEU  25           HN       LEU  25  14.755   4.688  26.651
  173    HA   LEU  25           HA       LEU  25  15.421   7.261  27.565
  174   1HB   LEU  25          HB2       LEU  25  13.031   5.516  28.115
  175   2HB   LEU  25          HB1       LEU  25  13.153   7.180  28.650
  176    HG   LEU  25           HG       LEU  25  13.208   6.280  25.768
  177   1HD1  LEU  25          HD11      LEU  25  11.018   5.947  26.783
  178   2HD1  LEU  25          HD12      LEU  25  10.985   7.288  25.638
  179   3HD1  LEU  25          HD13      LEU  25  11.027   7.610  27.371
  180   1HD2  LEU  25          HD21      LEU  25  13.100   9.038  26.985
  181   2HD2  LEU  25          HD22      LEU  25  13.003   8.661  25.265
  182   3HD2  LEU  25          HD23      LEU  25  14.486   8.325  26.159
  183    H    LYS  26           HN       LYS  26  15.815   4.215  29.128
  184    HA   LYS  26           HA       LYS  26  15.501   5.184  31.813
  185   1HB   LYS  26          HB2       LYS  26  16.270   3.060  32.546
  186   2HB   LYS  26          HB1       LYS  26  15.300   2.756  31.111
  187   1HG   LYS  26          HG2       LYS  26  17.384   2.633  29.783
  188   2HG   LYS  26          HG1       LYS  26  18.304   2.814  31.276
  189   1HD   LYS  26          HD2       LYS  26  18.049   0.457  30.485
  190   2HD   LYS  26          HD1       LYS  26  17.463   0.746  32.126
  191   1HE   LYS  26          HE2       LYS  26  15.210   0.769  31.408
  192   2HE   LYS  26          HE1       LYS  26  15.683   0.822  29.712
  193   1HZ   LYS  26          HZ1       LYS  26  16.234  -1.392  29.697
  194   2HZ   LYS  26          HZ2       LYS  26  14.927  -1.408  30.781
  195   3HZ   LYS  26          HZ3       LYS  26  16.514  -1.462  31.368
  196    H    ILE  27           HN       ILE  27  18.065   5.107  29.490
  197    HA   ILE  27           HA       ILE  27  19.939   5.968  31.568
  198    HB   ILE  27           HB       ILE  27  21.747   5.419  29.900
  199   1HG1  ILE  27          HG12      ILE  27  19.472   3.990  28.501
  200   2HG1  ILE  27          HG11      ILE  27  20.322   5.402  27.883
  201   1HG2  ILE  27          HG21      ILE  27  21.204   3.986  31.805
  202   2HG2  ILE  27          HG22      ILE  27  21.719   3.042  30.408
  203   3HG2  ILE  27          HG23      ILE  27  20.009   3.137  30.824
  204   1HD1  ILE  27          HD11      ILE  27  22.381   4.114  27.752
  205   2HD1  ILE  27          HD12      ILE  27  21.090   3.349  26.825
  206   3HD1  ILE  27          HD13      ILE  27  21.546   2.704  28.402
  207    H    GLY  28           HN       GLY  28  18.256   6.941  28.756
  208   1HA   GLY  28          HA2       GLY  28  18.048   9.214  28.109
  209   2HA   GLY  28          HA1       GLY  28  19.614   9.538  28.838
  210    H    SER  29           HN       SER  29  19.047   6.822  26.733
  211    HA   SER  29           HA       SER  29  21.097   7.805  24.927
  212   1HB   SER  29          HB2       SER  29  21.099   5.445  25.749
  213   2HB   SER  29          HB1       SER  29  19.583   5.178  24.893
  214    HG   SER  29           HG       SER  29  22.138   5.759  23.802
  215    HA   PRO  30           HA       PRO  30  18.120   9.166  21.912
  216   1HB   PRO  30          HB2       PRO  30  20.138   9.126  19.859
  217   2HB   PRO  30          HB1       PRO  30  19.496  10.517  20.732
  218   1HG   PRO  30          HG2       PRO  30  22.068   9.582  20.981
  219   2HG   PRO  30          HG1       PRO  30  21.225  10.531  22.218
  220   1HD   PRO  30          HD2       PRO  30  21.677   7.580  22.068
  221   2HD   PRO  30          HD1       PRO  30  21.714   8.659  23.479
  222    H    TRP  31           HN       TRP  31  18.033   8.690  19.281
  223    HA   TRP  31           HA       TRP  31  18.455   5.951  18.583
  224   1HB   TRP  31          HB2       TRP  31  16.022   5.471  18.153
  225   2HB   TRP  31          HB1       TRP  31  16.454   5.551  19.857
  226    HD1  TRP  31           HD1      TRP  31  14.793   7.798  17.158
  227    HE1  TRP  31           HE1      TRP  31  13.089   9.325  18.342
  228    HE3  TRP  31           HE3      TRP  31  15.710   6.427  21.998
  229    HZ2  TRP  31           HZ2      TRP  31  12.242   9.862  20.982
  230    HZ3  TRP  31           HZ3      TRP  31  14.407   7.492  23.792
  231    HH2  TRP  31           HH2      TRP  31  12.710   9.174  23.293
  232    H    VAL  32           HN       VAL  32  17.480   5.518  16.364
  233    HA   VAL  32           HA       VAL  32  17.766   7.935  14.745
  234    HB   VAL  32           HB       VAL  32  17.561   5.054  13.838
  235   1HG1  VAL  32          HG11      VAL  32  18.312   7.557  12.324
  236   2HG1  VAL  32          HG12      VAL  32  16.834   6.615  12.119
  237   3HG1  VAL  32          HG13      VAL  32  18.394   5.913  11.690
  238   1HG2  VAL  32          HG21      VAL  32  19.980   6.833  14.139
  239   2HG2  VAL  32          HG22      VAL  32  19.975   5.211  13.446
  240   3HG2  VAL  32          HG23      VAL  32  19.579   5.444  15.149
  241    H    HIS  33           HN       HIS  33  15.619   5.064  14.581
  242    HA   HIS  33           HA       HIS  33  13.375   6.919  14.235
  243   1HB   HIS  33          HB2       HIS  33  13.984   4.483  12.549
  244   2HB   HIS  33          HB1       HIS  33  12.396   5.236  12.602
  245    HD1  HIS  33           HD1      HIS  33  15.136   5.129  10.451
  246    HD2  HIS  33           HD2      HIS  33  12.897   8.264  12.041
  247    HE1  HIS  33           HE1      HIS  33  15.479   7.078   8.895
  248    HE2  HIS  33           HE2      HIS  33  13.943   8.880   9.759
  249    H    LEU  34           HN       LEU  34  11.489   6.311  15.185
  250    HA   LEU  34           HA       LEU  34  11.555   3.900  16.848
  251   1HB   LEU  34          HB2       LEU  34   9.716   6.296  16.918
  252   2HB   LEU  34          HB1       LEU  34   9.590   4.910  17.983
  253    HG   LEU  34           HG       LEU  34  11.919   6.825  17.868
  254   1HD1  LEU  34          HD11      LEU  34   9.743   6.467  19.922
  255   2HD1  LEU  34          HD12      LEU  34   9.917   7.831  18.818
  256   3HD1  LEU  34          HD13      LEU  34  11.131   7.545  20.064
  257   1HD2  LEU  34          HD21      LEU  34  12.610   4.564  18.470
  258   2HD2  LEU  34          HD22      LEU  34  11.363   4.506  19.716
  259   3HD2  LEU  34          HD23      LEU  34  12.702   5.645  19.861
  260    H    ARG  35           HN       ARG  35  10.222   2.229  16.457
  261    HA   ARG  35           HA       ARG  35   8.024   2.656  14.550
  262   1HB   ARG  35          HB2       ARG  35   9.768   0.185  14.701
  263   2HB   ARG  35          HB1       ARG  35   8.399   0.419  13.623
  264   1HG   ARG  35          HG2       ARG  35   9.622   2.317  12.576
  265   2HG   ARG  35          HG1       ARG  35  11.016   1.912  13.581
  266   1HD   ARG  35          HD2       ARG  35  10.792  -0.441  12.579
  267   2HD   ARG  35          HD1       ARG  35   9.762   0.316  11.369
  268    HE   ARG  35           HE       ARG  35  12.312   1.610  11.701
  269   1HH1  ARG  35          HH11      ARG  35  10.556  -0.883   9.983
  270   2HH1  ARG  35          HH12      ARG  35  11.756  -1.054   8.734
  271   1HH2  ARG  35          HH21      ARG  35  13.934   1.346  10.096
  272   2HH2  ARG  35          HH22      ARG  35  13.685   0.190   8.818
  273    H    ILE  36           HN       ILE  36   6.106   1.776  15.108
  274    HA   ILE  36           HA       ILE  36   5.976   0.680  17.828
  275    HB   ILE  36           HB       ILE  36   4.602   2.651  17.461
  276   1HG1  ILE  36          HG12      ILE  36   2.879   0.170  17.655
  277   2HG1  ILE  36          HG11      ILE  36   3.812   0.851  18.982
  278   1HG2  ILE  36          HG21      ILE  36   2.722   2.657  15.905
  279   2HG2  ILE  36          HG22      ILE  36   3.193   1.060  15.321
  280   3HG2  ILE  36          HG23      ILE  36   4.253   2.444  15.056
  281   1HD1  ILE  36          HD11      ILE  36   2.478   2.885  18.881
  282   2HD1  ILE  36          HD12      ILE  36   1.468   1.461  19.132
  283   3HD1  ILE  36          HD13      ILE  36   1.552   2.212  17.539
  284    H    CYS  37           HN       CYS  37   5.372  -1.275  18.240
  285    HA   CYS  37           HA       CYS  37   5.138  -3.188  16.117
  286   1HB   CYS  37          HB2       CYS  37   6.344  -3.576  18.245
  287   2HB   CYS  37          HB1       CYS  37   4.816  -3.474  19.105
  288    H    ARG  38           HN       ARG  38   3.266  -3.567  15.074
  289    HA   ARG  38           HA       ARG  38   0.837  -2.365  15.970
  290   1HB   ARG  38          HB2       ARG  38   1.480  -4.133  13.618
  291   2HB   ARG  38          HB1       ARG  38  -0.124  -3.480  13.913
  292   1HG   ARG  38          HG2       ARG  38   2.373  -1.852  13.480
  293   2HG   ARG  38          HG1       ARG  38   1.121  -2.163  12.277
  294   1HD   ARG  38          HD2       ARG  38   0.850  -0.615  14.849
  295   2HD   ARG  38          HD1       ARG  38   0.748   0.012  13.204
  296    HE   ARG  38           HE       ARG  38  -1.226  -1.925  14.212
  297   1HH1  ARG  38          HH11      ARG  38  -0.439   1.187  12.788
  298   2HH1  ARG  38          HH12      ARG  38  -2.102   1.596  12.494
  299   1HH2  ARG  38          HH21      ARG  38  -3.403  -1.357  13.828
  300   2HH2  ARG  38          HH22      ARG  38  -3.773   0.169  13.084
  301    H    THR  39           HN       THR  39   2.167  -5.133  17.053
  302    HA   THR  39           HA       THR  39  -0.336  -6.637  17.124
  303    HB   THR  39           HB       THR  39   2.253  -7.542  18.358
  304    HG1  THR  39           HG1      THR  39   1.809  -8.535  15.851
  305   1HG2  THR  39          HG21      THR  39   1.353  -9.766  17.820
  306   2HG2  THR  39          HG22      THR  39  -0.084  -9.011  17.131
  307   3HG2  THR  39          HG23      THR  39   0.255  -8.851  18.855
  308    H    CYS  40           HN       CYS  40   2.171  -5.601  19.440
  309    HA   CYS  40           HA       CYS  40   0.210  -5.933  21.592
  310   1HB   CYS  40          HB2       CYS  40   2.143  -6.084  23.100
  311   2HB   CYS  40          HB1       CYS  40   2.282  -7.237  21.781
  312    H    GLY  41           HN       GLY  41   1.861  -3.531  19.819
  313   1HA   GLY  41          HA2       GLY  41   1.427  -1.249  19.909
  314   2HA   GLY  41          HA1       GLY  41   0.632  -1.486  21.454
  315    H    HIS  42           HN       HIS  42   3.870  -2.735  21.034
  316    HA   HIS  42           HA       HIS  42   4.761  -0.718  22.954
  317   1HB   HIS  42          HB2       HIS  42   5.193  -3.288  23.167
  318   2HB   HIS  42          HB1       HIS  42   6.500  -2.980  22.027
  319    HD1  HIS  42           HD1      HIS  42   8.662  -2.138  23.004
  320    HD2  HIS  42           HD2      HIS  42   5.459  -1.757  25.636
  321    HE1  HIS  42           HE1      HIS  42   9.654  -1.355  25.183
  322    HE2  HIS  42           HE2      HIS  42   7.703  -1.151  26.769
  323    H    VAL  43           HN       VAL  43   6.307   0.770  22.542
  324    HA   VAL  43           HA       VAL  43   7.167   1.027  19.741
  325    HB   VAL  43           HB       VAL  43   7.127   3.163  21.886
  326   1HG1  VAL  43          HG11      VAL  43   8.733   3.608  20.115
  327   2HG1  VAL  43          HG12      VAL  43   7.371   4.723  20.008
  328   3HG1  VAL  43          HG13      VAL  43   7.483   3.358  18.897
  329   1HG2  VAL  43          HG21      VAL  43   5.130   2.613  19.694
  330   2HG2  VAL  43          HG22      VAL  43   5.137   4.041  20.730
  331   3HG2  VAL  43          HG23      VAL  43   4.860   2.446  21.429
  332    H    GLY  44           HN       GLY  44   9.337   1.305  19.236
  333   1HA   GLY  44          HA2       GLY  44  11.318   1.747  21.262
  334   2HA   GLY  44          HA1       GLY  44  11.304   0.085  20.690
  335    H    CYS  45           HN       CYS  45  13.565   1.537  20.357
  336    HA   CYS  45           HA       CYS  45  13.676   2.797  17.801
  337   1HB   CYS  45          HB2       CYS  45  16.163   2.618  18.126
  338   2HB   CYS  45          HB1       CYS  45  15.313   3.447  19.424
  339    HG   CYS  45           HG       CYS  45  17.263   2.013  20.679
  340    H    CYS  46           HN       CYS  46  14.178   1.963  15.859
  341    HA   CYS  46           HA       CYS  46  13.795  -0.896  15.652
  342   1HB   CYS  46          HB2       CYS  46  13.665  -0.281  13.168
  343   2HB   CYS  46          HB1       CYS  46  12.403   0.323  14.233
  344    HG   CYS  46           HG       CYS  46  14.535   1.986  12.334
  345    H    ASP  47           HN       ASP  47  14.940  -1.537  13.301
  346    HA   ASP  47           HA       ASP  47  17.529  -2.312  13.981
  347   1HB   ASP  47          HB2       ASP  47  16.042  -3.414  12.304
  348   2HB   ASP  47          HB1       ASP  47  16.345  -2.076  11.204
  349    H    ASP  48           HN       ASP  48  16.350   0.577  12.510
  350    HA   ASP  48           HA       ASP  48  18.555   1.684  11.283
  351   1HB   ASP  48          HB2       ASP  48  16.541   3.070  13.072
  352   2HB   ASP  48          HB1       ASP  48  17.640   3.890  11.973
  353    H    SER  49           HN       SER  49  17.912   1.261  14.699
  354    HA   SER  49           HA       SER  49  20.281   2.860  15.393
  355   1HB   SER  49          HB2       SER  49  18.091   1.902  17.247
  356   2HB   SER  49          HB1       SER  49  19.304   3.145  17.565
  357    HG   SER  49           HG       SER  49  17.910   3.701  15.324
  358    HA   PRO  50           HA       PRO  50  22.553  -0.757  16.361
  359   1HB   PRO  50          HB2       PRO  50  24.093   0.101  18.444
  360   2HB   PRO  50          HB1       PRO  50  24.381   0.553  16.760
  361   1HG   PRO  50          HG2       PRO  50  22.992   2.085  18.924
  362   2HG   PRO  50          HG1       PRO  50  24.150   2.661  17.710
  363   1HD   PRO  50          HD2       PRO  50  21.496   3.045  17.450
  364   2HD   PRO  50          HD1       PRO  50  22.548   2.762  16.048
  365    H    HIS  51           HN       HIS  51  20.531   0.642  18.786
  366    HA   HIS  51           HA       HIS  51  20.946  -1.409  20.751
  367   1HB   HIS  51          HB2       HIS  51  20.030   1.027  21.058
  368   2HB   HIS  51          HB1       HIS  51  18.480   0.300  20.652
  369    HD1  HIS  51           HD1      HIS  51  20.280   1.255  23.486
  370    HD2  HIS  51           HD2      HIS  51  18.195  -2.204  22.479
  371    HE1  HIS  51           HE1      HIS  51  19.697   0.148  25.670
  372    HE2  HIS  51           HE2      HIS  51  18.556  -2.008  25.037
  373    H    LYS  52           HN       LYS  52  18.816  -0.860  18.054
  374    HA   LYS  52           HA       LYS  52  17.291  -2.147  16.964
  375   1HB   LYS  52          HB2       LYS  52  18.978  -4.433  17.987
  376   2HB   LYS  52          HB1       LYS  52  18.036  -4.378  16.500
  377   1HG   LYS  52          HG2       LYS  52  19.798  -2.186  16.428
  378   2HG   LYS  52          HG1       LYS  52  20.738  -3.579  16.949
  379   1HD   LYS  52          HD2       LYS  52  18.966  -3.515  14.515
  380   2HD   LYS  52          HD1       LYS  52  20.709  -3.249  14.493
  381   1HE   LYS  52          HE2       LYS  52  21.002  -5.507  15.494
  382   2HE   LYS  52          HE1       LYS  52  19.263  -5.757  15.326
  383   1HZ   LYS  52          HZ1       LYS  52  21.221  -5.310  13.144
  384   2HZ   LYS  52          HZ2       LYS  52  19.542  -5.333  12.914
  385   3HZ   LYS  52          HZ3       LYS  52  20.344  -6.726  13.456
  386    H    HIS  53           HN       HIS  53  16.235  -1.440  19.373
  387    HA   HIS  53           HA       HIS  53  15.469  -3.626  21.014
  388   1HB   HIS  53          HB2       HIS  53  15.574  -1.258  21.785
  389   2HB   HIS  53          HB1       HIS  53  14.166  -0.901  20.794
  390    HD1  HIS  53           HD1      HIS  53  12.714  -0.250  22.814
  391    HD2  HIS  53           HD2      HIS  53  14.216  -4.119  23.030
  392    HE1  HIS  53           HE1      HIS  53  11.470  -1.354  24.697
  393    HE2  HIS  53           HE2      HIS  53  12.506  -3.641  24.913
  394    H    ALA  54           HN       ALA  54  14.095  -2.182  18.149
  395    HA   ALA  54           HA       ALA  54  11.504  -3.362  18.469
  396   1HB   ALA  54          HB1       ALA  54  11.946  -1.297  17.140
  397   2HB   ALA  54          HB2       ALA  54  11.003  -2.523  16.295
  398   3HB   ALA  54          HB3       ALA  54  12.711  -2.315  15.919
  399    H    THR  55           HN       THR  55  14.460  -4.288  16.750
  400    HA   THR  55           HA       THR  55  13.160  -6.423  15.337
  401    HB   THR  55           HB       THR  55  15.455  -7.059  14.622
  402    HG1  THR  55           HG1      THR  55  17.136  -6.255  15.610
  403   1HG2  THR  55          HG21      THR  55  14.182  -5.437  13.320
  404   2HG2  THR  55          HG22      THR  55  15.899  -5.031  13.309
  405   3HG2  THR  55          HG23      THR  55  14.786  -4.129  14.338
  406    H    ARG  56           HN       ARG  56  15.348  -6.177  18.120
  407    HA   ARG  56           HA       ARG  56  15.497  -8.954  18.627
  408   1HB   ARG  56          HB2       ARG  56  15.842  -6.599  20.489
  409   2HB   ARG  56          HB1       ARG  56  16.207  -8.265  20.923
  410   1HG   ARG  56          HG2       ARG  56  17.852  -8.357  19.102
  411   2HG   ARG  56          HG1       ARG  56  17.514  -6.664  18.738
  412   1HD   ARG  56          HD2       ARG  56  18.274  -6.019  20.957
  413   2HD   ARG  56          HD1       ARG  56  18.565  -7.712  21.362
  414    HE   ARG  56           HE       ARG  56  20.113  -7.502  19.251
  415   1HH1  ARG  56          HH11      ARG  56  19.698  -5.269  21.910
  416   2HH1  ARG  56          HH12      ARG  56  21.284  -4.567  21.741
  417   1HH2  ARG  56          HH21      ARG  56  22.186  -6.598  19.012
  418   2HH2  ARG  56          HH22      ARG  56  22.703  -5.332  20.086
  419    H    HIS  57           HN       HIS  57  13.152  -6.513  19.413
  420    HA   HIS  57           HA       HIS  57  11.660  -7.935  21.321
  421   1HB   HIS  57          HB2       HIS  57  11.225  -5.591  20.978
  422   2HB   HIS  57          HB1       HIS  57  10.828  -5.860  19.284
  423    HD1  HIS  57           HD1      HIS  57   9.416  -6.393  22.755
  424    HD2  HIS  57           HD2      HIS  57   8.260  -6.626  18.764
  425    HE1  HIS  57           HE1      HIS  57   6.911  -6.721  22.752
  426    H    PHE  58           HN       PHE  58  11.411  -7.773  17.788
  427    HA   PHE  58           HA       PHE  58   9.256  -9.549  17.495
  428   1HB   PHE  58          HB2       PHE  58   9.764  -8.282  15.593
  429   2HB   PHE  58          HB1       PHE  58  11.479  -8.672  15.676
  430    HD1  PHE  58           HD1      PHE  58   8.213 -10.444  15.279
  431    HD2  PHE  58           HD2      PHE  58  12.289 -10.136  14.137
  432    HE1  PHE  58           HE1      PHE  58   7.888 -12.259  13.652
  433    HE2  PHE  58           HE2      PHE  58  11.974 -11.946  12.503
  434    HZ   PHE  58           HZ       PHE  58   9.773 -13.011  12.262
  435    H    HIS  59           HN       HIS  59  12.725 -10.064  17.665
  436    HA   HIS  59           HA       HIS  59  12.789 -12.778  16.980
  437   1HB   HIS  59          HB2       HIS  59  14.719 -11.081  17.286
  438   2HB   HIS  59          HB1       HIS  59  14.665 -11.543  18.983
  439    HD1  HIS  59           HD1      HIS  59  15.688 -13.783  19.625
  440    HD2  HIS  59           HD2      HIS  59  15.589 -13.117  15.520
  441    HE1  HIS  59           HE1      HIS  59  17.115 -15.591  18.606
  442    HE2  HIS  59           HE2      HIS  59  17.218 -15.024  16.148
  443    H    ALA  60           HN       ALA  60  11.874 -11.175  19.913
  444    HA   ALA  60           HA       ALA  60  11.942 -13.655  21.451
  445   1HB   ALA  60          HB1       ALA  60  11.246 -10.858  22.332
  446   2HB   ALA  60          HB2       ALA  60  12.839 -11.605  22.456
  447   3HB   ALA  60          HB3       ALA  60  11.485 -12.258  23.379
  448    H    THR  61           HN       THR  61   9.581 -11.122  20.573
  449    HA   THR  61           HA       THR  61   7.424 -12.576  21.819
  450    HB   THR  61           HB       THR  61   5.991 -10.733  20.857
  451    HG1  THR  61           HG1      THR  61   8.526  -9.612  20.170
  452   1HG2  THR  61          HG21      THR  61   8.346  -9.826  22.511
  453   2HG2  THR  61          HG22      THR  61   6.931 -10.668  23.142
  454   3HG2  THR  61          HG23      THR  61   6.755  -9.062  22.430
  455    H    GLY  62           HN       GLY  62   8.716 -12.309  18.608
  456   1HA   GLY  62          HA2       GLY  62   8.078 -13.362  16.655
  457   2HA   GLY  62          HA1       GLY  62   6.843 -14.214  17.573
  458    H    HIS  63           HN       HIS  63   7.213 -10.729  17.408
  459    HA   HIS  63           HA       HIS  63   4.570 -10.545  16.124
  460   1HB   HIS  63          HB2       HIS  63   6.126  -8.509  17.739
  461   2HB   HIS  63          HB1       HIS  63   4.601  -8.171  16.933
  462    HD2  HIS  63           HD2      HIS  63   3.762 -11.430  18.231
  463    HE1  HIS  63           HE1      HIS  63   3.286  -8.849  21.559
  464    HE2  HIS  63           HE2      HIS  63   2.582 -11.059  20.522
  465    HA   PRO  64           HA       PRO  64   7.474  -9.666  12.817
  466   1HB   PRO  64          HB2       PRO  64   5.943 -10.420  10.757
  467   2HB   PRO  64          HB1       PRO  64   6.640 -11.593  11.881
  468   1HG   PRO  64          HG2       PRO  64   3.859 -10.499  11.765
  469   2HG   PRO  64          HG1       PRO  64   4.397 -12.163  12.060
  470   1HD   PRO  64          HD2       PRO  64   3.651 -10.399  14.038
  471   2HD   PRO  64          HD1       PRO  64   4.735 -11.781  14.288
  472    H    ILE  65           HN       ILE  65   4.442  -8.032  13.285
  473    HA   ILE  65           HA       ILE  65   5.068  -6.316  10.980
  474    HB   ILE  65           HB       ILE  65   2.381  -6.719  12.291
  475   1HG1  ILE  65          HG12      ILE  65   3.452  -7.576   9.588
  476   2HG1  ILE  65          HG11      ILE  65   3.161  -8.645  10.954
  477   1HG2  ILE  65          HG21      ILE  65   3.200  -5.055   9.907
  478   2HG2  ILE  65          HG22      ILE  65   2.623  -4.450  11.460
  479   3HG2  ILE  65          HG23      ILE  65   1.538  -5.358  10.409
  480   1HD1  ILE  65          HD11      ILE  65   1.064  -7.073   9.478
  481   2HD1  ILE  65          HD12      ILE  65   0.780  -8.172  10.827
  482   3HD1  ILE  65          HD13      ILE  65   1.392  -8.795   9.295
  483    H    ILE  66           HN       ILE  66   5.666  -4.345  11.274
  484    HA   ILE  66           HA       ILE  66   4.937  -2.925  13.747
  485    HB   ILE  66           HB       ILE  66   7.158  -1.828  13.712
  486   1HG1  ILE  66          HG12      ILE  66   7.852  -3.945  11.661
  487   2HG1  ILE  66          HG11      ILE  66   7.636  -2.233  11.308
  488   1HG2  ILE  66          HG21      ILE  66   8.434  -3.771  14.572
  489   2HG2  ILE  66          HG22      ILE  66   7.161  -4.828  13.962
  490   3HG2  ILE  66          HG23      ILE  66   6.801  -3.657  15.230
  491   1HD1  ILE  66          HD11      ILE  66   9.972  -2.730  11.454
  492   2HD1  ILE  66          HD12      ILE  66   9.758  -3.465  13.044
  493   3HD1  ILE  66          HD13      ILE  66   9.508  -1.732  12.833
  494    H    GLU  67           HN       GLU  67   5.056  -0.571  13.520
  495    HA   GLU  67           HA       GLU  67   4.702   0.339  10.741
  496   1HB   GLU  67          HB2       GLU  67   2.513   0.106  11.767
  497   2HB   GLU  67          HB1       GLU  67   3.032   1.036  13.164
  498   1HG   GLU  67          HG2       GLU  67   3.190   3.033  11.840
  499   2HG   GLU  67          HG1       GLU  67   2.846   2.126  10.366
  500    H    GLY  68           HN       GLY  68   5.423   2.441  10.293
  501   1HA   GLY  68          HA2       GLY  68   7.572   3.382  11.922
  502   2HA   GLY  68          HA1       GLY  68   6.935   4.172  10.486
  503    H    TYR  69           HN       TYR  69   7.236   4.364  13.815
  504    HA   TYR  69           HA       TYR  69   4.832   5.987  14.161
  505   1HB   TYR  69          HB2       TYR  69   5.568   4.159  15.815
  506   2HB   TYR  69          HB1       TYR  69   6.818   5.291  16.320
  507    HD1  TYR  69           HD1      TYR  69   3.251   5.860  15.412
  508    HD2  TYR  69           HD2      TYR  69   6.220   6.026  18.456
  509    HE1  TYR  69           HE1      TYR  69   1.633   6.925  16.923
  510    HE2  TYR  69           HE2      TYR  69   4.607   7.095  19.976
  511    HH   TYR  69           HH       TYR  69   1.229   7.338  19.185
  512    H    ASP  70           HN       ASP  70   8.361   6.206  14.455
  513    HA   ASP  70           HA       ASP  70   8.397   8.983  15.048
  514   1HB   ASP  70          HB2       ASP  70  10.363   7.761  15.591
  515   2HB   ASP  70          HB1       ASP  70  10.520   7.134  13.959
  516    HA   PRO  71           HA       PRO  71   8.187   9.710  10.434
  517   1HB   PRO  71          HB2       PRO  71   8.709   7.749   8.635
  518   2HB   PRO  71          HB1       PRO  71   9.983   8.708   9.394
  519   1HG   PRO  71          HG2       PRO  71   9.343   5.893   9.766
  520   2HG   PRO  71          HG1       PRO  71  10.763   6.794  10.318
  521   1HD   PRO  71          HD2       PRO  71   8.332   6.070  11.792
  522   2HD   PRO  71          HD1       PRO  71   9.898   6.625  12.408
  523    HA   PRO  72           HA       PRO  72   4.161   7.474  10.710
  524   1HB   PRO  72          HB2       PRO  72   2.909  10.093  10.699
  525   2HB   PRO  72          HB1       PRO  72   2.911   8.874  11.975
  526   1HG   PRO  72          HG2       PRO  72   4.219  11.253  12.183
  527   2HG   PRO  72          HG1       PRO  72   4.742   9.777  13.013
  528   1HD   PRO  72          HD2       PRO  72   5.788  11.003  10.486
  529   2HD   PRO  72          HD1       PRO  72   6.681  10.269  11.837
  530    H    GLU  73           HN       GLU  73   4.498   6.788   8.543
  531    HA   GLU  73           HA       GLU  73   3.297   8.558   6.513
  532   1HB   GLU  73          HB2       GLU  73   5.106   6.175   6.099
  533   2HB   GLU  73          HB1       GLU  73   4.509   7.254   4.847
  534   1HG   GLU  73          HG2       GLU  73   5.794   9.074   5.733
  535   2HG   GLU  73          HG1       GLU  73   6.289   8.100   7.118
  536    H    GLY  74           HN       GLY  74   2.797   5.803   8.377
  537   1HA   GLY  74          HA2       GLY  74   0.914   4.466   8.485
  538   2HA   GLY  74          HA1       GLY  74   0.323   5.241   7.025
  539    H    TRP  75           HN       TRP  75   2.952   3.048   8.023
  540    HA   TRP  75           HA       TRP  75   2.098   1.213   5.934
  541   1HB   TRP  75          HB2       TRP  75   4.514   0.817   5.285
  542   2HB   TRP  75          HB1       TRP  75   3.805   2.326   4.730
  543    HD1  TRP  75           HD1      TRP  75   4.945   4.527   5.451
  544    HE1  TRP  75           HE1      TRP  75   7.074   5.115   6.776
  545    HE3  TRP  75           HE3      TRP  75   5.988  -0.093   7.375
  546    HZ2  TRP  75           HZ2      TRP  75   8.943   3.784   8.424
  547    HZ3  TRP  75           HZ3      TRP  75   7.968  -0.351   8.812
  548    HH2  TRP  75           HH2      TRP  75   9.413   1.548   9.325
  549    H    GLY  76           HN       GLY  76   2.660  -0.927   6.272
  550   1HA   GLY  76          HA2       GLY  76   3.616  -1.491   9.009
  551   2HA   GLY  76          HA1       GLY  76   2.404  -2.456   8.174
  552    H    TRP  77           HN       TRP  77   5.545  -2.370   9.075
  553    HA   TRP  77           HA       TRP  77   6.551  -3.805   6.732
  554   1HB   TRP  77          HB2       TRP  77   7.999  -2.073   7.720
  555   2HB   TRP  77          HB1       TRP  77   7.978  -2.930   9.257
  556    HD1  TRP  77           HD1      TRP  77   9.712  -4.856   9.578
  557    HE1  TRP  77           HE1      TRP  77  11.572  -5.870   8.106
  558    HE3  TRP  77           HE3      TRP  77   8.541  -2.606   5.137
  559    HZ2  TRP  77           HZ2      TRP  77  12.418  -5.726   5.420
  560    HZ3  TRP  77           HZ3      TRP  77   9.927  -3.099   3.165
  561    HH2  TRP  77           HH2      TRP  77  11.825  -4.627   3.305
  562    H    CYS  78           HN       CYS  78   6.674  -5.946   6.679
  563    HA   CYS  78           HA       CYS  78   6.077  -7.409   9.168
  564   1HB   CYS  78          HB2       CYS  78   4.519  -7.536   7.110
  565   2HB   CYS  78          HB1       CYS  78   5.785  -8.505   6.375
  566    H    TYR  79           HN       TYR  79   7.979  -8.007  10.038
  567    HA   TYR  79           HA       TYR  79  10.453  -8.127   8.902
  568   1HB   TYR  79          HB2       TYR  79   9.320  -9.715  11.192
  569   2HB   TYR  79          HB1       TYR  79  11.015  -9.812  10.739
  570    HD1  TYR  79           HD1      TYR  79  12.315  -7.561  10.676
  571    HD2  TYR  79           HD2      TYR  79   8.622  -8.109  12.716
  572    HE1  TYR  79           HE1      TYR  79  12.830  -5.635  12.116
  573    HE2  TYR  79           HE2      TYR  79   9.122  -6.179  14.150
  574    HH   TYR  79           HH       TYR  79  11.129  -4.968  14.953
  575    H    VAL  80           HN       VAL  80   8.392 -11.000   9.399
  576    HA   VAL  80           HA       VAL  80  10.239 -12.781   8.217
  577    HB   VAL  80           HB       VAL  80   8.331 -14.413   8.206
  578   1HG1  VAL  80          HG11      VAL  80   8.168 -14.517  10.673
  579   2HG1  VAL  80          HG12      VAL  80   8.916 -12.921  10.761
  580   3HG1  VAL  80          HG13      VAL  80   9.818 -14.284  10.097
  581   1HG2  VAL  80          HG21      VAL  80   6.279 -13.750   9.408
  582   2HG2  VAL  80          HG22      VAL  80   6.481 -12.888   7.883
  583   3HG2  VAL  80          HG23      VAL  80   6.843 -12.079   9.408
  584    H    ASP  81           HN       ASP  81   7.908 -10.693   6.831
  585    HA   ASP  81           HA       ASP  81   7.771 -12.216   4.332
  586   1HB   ASP  81          HB2       ASP  81   6.404  -9.627   5.112
  587   2HB   ASP  81          HB1       ASP  81   6.140 -10.507   3.616
  588    H    GLU  82           HN       GLU  82   9.050  -9.296   5.728
  589    HA   GLU  82           HA       GLU  82  10.387  -7.634   5.012
  590   1HB   GLU  82          HB2       GLU  82  11.143  -9.749   3.017
  591   2HB   GLU  82          HB1       GLU  82  11.850  -8.138   2.961
  592   1HG   GLU  82          HG2       GLU  82  12.619  -8.434   5.286
  593   2HG   GLU  82          HG1       GLU  82  11.992 -10.082   5.253
  594    H    VAL  83           HN       VAL  83   7.641  -7.890   4.124
  595    HA   VAL  83           HA       VAL  83   7.792  -6.185   1.735
  596    HB   VAL  83           HB       VAL  83   5.514  -6.795   1.194
  597   1HG1  VAL  83          HG11      VAL  83   7.229  -8.211   0.271
  598   2HG1  VAL  83          HG12      VAL  83   5.817  -9.188   0.677
  599   3HG1  VAL  83          HG13      VAL  83   7.234  -9.207   1.727
  600   1HG2  VAL  83          HG21      VAL  83   4.311  -8.549   2.441
  601   2HG2  VAL  83          HG22      VAL  83   4.587  -7.098   3.405
  602   3HG2  VAL  83          HG23      VAL  83   5.587  -8.528   3.657
  603    H    MET  84           HN       MET  84   6.644  -4.265   1.725
  604    HA   MET  84           HA       MET  84   5.653  -3.391   4.359
  605   1HB   MET  84          HB2       MET  84   7.645  -2.177   3.582
  606   2HB   MET  84          HB1       MET  84   6.800  -1.733   2.105
  607   1HG   MET  84          HG2       MET  84   5.138  -0.519   3.489
  608   2HG   MET  84          HG1       MET  84   6.128  -0.868   4.905
  609   1HE   MET  84          HE1       MET  84   9.067  -0.608   3.785
  610   2HE   MET  84          HE2       MET  84   8.566   0.140   5.302
  611   3HE   MET  84          HE3       MET  84   9.425   1.092   4.091
  612    H    PHE  85           HN       PHE  85   3.501  -3.522   4.366
  613    HA   PHE  85           HA       PHE  85   2.034  -2.714   1.961
  614   1HB   PHE  85          HB2       PHE  85   0.038  -3.693   3.138
  615   2HB   PHE  85          HB1       PHE  85   1.305  -4.850   2.755
  616    HD1  PHE  85           HD1      PHE  85  -0.425  -3.059   5.434
  617    HD2  PHE  85           HD2      PHE  85   2.583  -5.917   4.488
  618    HE1  PHE  85           HE1      PHE  85  -0.383  -3.789   7.781
  619    HE2  PHE  85           HE2      PHE  85   2.631  -6.651   6.836
  620    HZ   PHE  85           HZ       PHE  85   1.146  -5.584   8.484
  621    H    ASP  86           HN       ASP  86  -0.053  -1.455   2.451
  622    HA   ASP  86           HA       ASP  86   0.860   0.877   3.928
  623   1HB   ASP  86          HB2       ASP  86  -0.846   2.116   2.763
  624   2HB   ASP  86          HB1       ASP  86   0.018   1.118   1.600
  625    H    LEU  87           HN       LEU  87  -0.061   1.719   5.663
  626    HA   LEU  87           HA       LEU  87  -2.547   0.538   6.701
  627   1HB   LEU  87          HB2       LEU  87   0.035   1.012   8.184
  628   2HB   LEU  87          HB1       LEU  87  -1.502   0.869   9.013
  629    HG   LEU  87           HG       LEU  87  -0.270  -1.281   7.286
  630   1HD1  LEU  87          HD11      LEU  87  -0.450  -1.035  10.287
  631   2HD1  LEU  87          HD12      LEU  87   1.020  -0.900   9.322
  632   3HD1  LEU  87          HD13      LEU  87   0.153  -2.434   9.399
  633   1HD2  LEU  87          HD21      LEU  87  -2.716  -1.355   7.351
  634   2HD2  LEU  87          HD22      LEU  87  -2.670  -1.327   9.114
  635   3HD2  LEU  87          HD23      LEU  87  -2.007  -2.706   8.236
  636    H    SER  88           HN       SER  88  -1.877   3.017   5.239
  637    HA   SER  88           HA       SER  88  -1.466   5.203   6.916
  638   1HB   SER  88          HB2       SER  88  -1.229   5.152   4.411
  639   2HB   SER  88          HB1       SER  88  -2.985   5.259   4.306
  640    HG   SER  88           HG       SER  88  -2.374   7.331   4.229
  641    H    ASP  89           HN       ASP  89  -4.495   3.646   5.931
  642    HA   ASP  89           HA       ASP  89  -6.059   5.690   7.284
  643   1HB   ASP  89          HB2       ASP  89  -6.842   3.197   5.779
  644   2HB   ASP  89          HB1       ASP  89  -8.013   4.187   6.644
  645    H    ARG  90           HN       ARG  90  -4.305   3.190   8.380
  646    HA   ARG  90           HA       ARG  90  -6.103   2.767  10.679
  647   1HB   ARG  90          HB2       ARG  90  -4.347   0.665   9.385
  648   2HB   ARG  90          HB1       ARG  90  -5.337   0.436  10.820
  649   1HG   ARG  90          HG2       ARG  90  -7.352   0.807   9.496
  650   2HG   ARG  90          HG1       ARG  90  -6.360   1.049   8.056
  651   1HD   ARG  90          HD2       ARG  90  -5.486  -1.236   8.299
  652   2HD   ARG  90          HD1       ARG  90  -6.524  -1.472   9.705
  653    HE   ARG  90           HE       ARG  90  -8.061  -0.655   7.468
  654   1HH1  ARG  90          HH11      ARG  90  -6.361  -3.432   8.753
  655   2HH1  ARG  90          HH12      ARG  90  -7.349  -4.589   7.916
  656   1HH2  ARG  90          HH21      ARG  90  -9.363  -2.144   6.384
  657   2HH2  ARG  90          HH22      ARG  90  -9.091  -3.850   6.583
  658    H    MET  91           HN       MET  91  -3.645   4.439   9.972
  659    HA   MET  91           HA       MET  91  -1.409   3.291  11.285
  660   1HB   MET  91          HB2       MET  91  -0.333   5.457  10.963
  661   2HB   MET  91          HB1       MET  91  -1.146   4.937   9.494
  662   1HG   MET  91          HG2       MET  91  -2.958   6.458   9.893
  663   2HG   MET  91          HG1       MET  91  -2.295   6.896  11.467
  664   1HE   MET  91          HE1       MET  91   0.961   8.803  10.510
  665   2HE   MET  91          HE2       MET  91   0.820   7.076  10.840
  666   3HE   MET  91          HE3       MET  91  -0.078   8.238  11.818
  667    H    THR  92           HN       THR  92  -0.358   3.976  13.167
  668    HA   THR  92           HA       THR  92  -2.166   4.696  15.312
  669    HB   THR  92           HB       THR  92   0.808   4.320  15.596
  670    HG1  THR  92           HG1      THR  92   0.098   2.514  14.432
  671   1HG2  THR  92          HG21      THR  92   0.166   3.447  17.793
  672   2HG2  THR  92          HG22      THR  92  -1.535   3.692  17.398
  673   3HG2  THR  92          HG23      THR  92  -0.456   5.079  17.553
  674    HA   PRO  93           HA       PRO  93  -0.911   9.001  14.864
  675   1HB   PRO  93          HB2       PRO  93  -2.698  10.022  16.608
  676   2HB   PRO  93          HB1       PRO  93  -3.161   9.500  14.984
  677   1HG   PRO  93          HG2       PRO  93  -3.477   8.072  17.594
  678   2HG   PRO  93          HG1       PRO  93  -4.619   8.205  16.244
  679   1HD   PRO  93          HD2       PRO  93  -3.041   6.016  16.681
  680   2HD   PRO  93          HD1       PRO  93  -3.624   6.500  15.077
  681    H    HIS  94           HN       HIS  94   0.102  10.581  16.230
  682    HA   HIS  94           HA       HIS  94   1.340   9.346  18.567
  683   1HB   HIS  94          HB2       HIS  94   3.021  11.037  18.477
  684   2HB   HIS  94          HB1       HIS  94   2.755  10.500  16.828
  685    HD1  HIS  94           HD1      HIS  94   1.893  12.243  15.139
  686    HD2  HIS  94           HD2      HIS  94   2.214  13.683  19.033
  687    HE1  HIS  94           HE1      HIS  94   1.663  14.741  14.966
  688    HE2  HIS  94           HE2      HIS  94   2.037  15.600  17.308
  689    H    ASN  95           HN       ASN  95   0.858   9.859  20.600
  690    HA   ASN  95           HA       ASN  95  -1.294  11.790  21.002
  691   1HB   ASN  95          HB2       ASN  95  -1.543  10.783  23.223
  692   2HB   ASN  95          HB1       ASN  95  -1.575   9.549  21.969
  693   1HD2  ASN  95          HD21      ASN  95   0.105   8.086  21.822
  694   2HD2  ASN  95          HD22      ASN  95   1.278   7.890  23.076
  695    H    GLY  96           HN       GLY  96   2.041  11.714  21.192
  696   1HA   GLY  96          HA2       GLY  96   2.047  14.188  22.729
  697   2HA   GLY  96          HA1       GLY  96   2.993  12.856  23.378
  698    HA   PRO  97           HA       PRO  97   5.491  15.193  20.180
  699   1HB   PRO  97          HB2       PRO  97   7.062  16.499  22.163
  700   2HB   PRO  97          HB1       PRO  97   5.877  17.229  21.081
  701   1HG   PRO  97          HG2       PRO  97   5.627  17.018  23.842
  702   2HG   PRO  97          HG1       PRO  97   4.300  17.321  22.710
  703   1HD   PRO  97          HD2       PRO  97   5.124  14.775  24.031
  704   2HD   PRO  97          HD1       PRO  97   3.498  15.366  23.626
  705    H    ILE  98           HN       ILE  98   6.889  13.743  19.424
  706    HA   ILE  98           HA       ILE  98   8.640  12.298  21.271
  707    HB   ILE  98           HB       ILE  98   8.142  11.888  18.317
  708   1HG1  ILE  98          HG12      ILE  98   7.176  10.357  20.743
  709   2HG1  ILE  98          HG11      ILE  98   6.187  11.374  19.702
  710   1HG2  ILE  98          HG21      ILE  98  10.363  11.139  18.919
  711   2HG2  ILE  98          HG22      ILE  98   9.319   9.747  18.631
  712   3HG2  ILE  98          HG23      ILE  98   9.714  10.227  20.282
  713   1HD1  ILE  98          HD11      ILE  98   7.556   8.812  18.922
  714   2HD1  ILE  98          HD12      ILE  98   6.624   9.841  17.834
  715   3HD1  ILE  98          HD13      ILE  98   5.830   9.047  19.194
  716    HA   PRO  99           HA       PRO  99  12.061  14.987  20.248
  717   1HB   PRO  99          HB2       PRO  99  14.012  13.327  21.246
  718   2HB   PRO  99          HB1       PRO  99  13.060  14.447  22.224
  719   1HG   PRO  99          HG2       PRO  99  12.716  11.508  21.826
  720   2HG   PRO  99          HG1       PRO  99  12.518  12.473  23.301
  721   1HD   PRO  99          HD2       PRO  99  10.416  11.608  21.843
  722   2HD   PRO  99          HD1       PRO  99  10.391  13.150  22.722
  723    H    ARG 100           HN       ARG 100  12.443  15.073  18.149
  724    HA   ARG 100           HA       ARG 100  13.094  12.714  16.596
  725   1HB   ARG 100          HB2       ARG 100  11.533  14.415  15.737
  726   2HB   ARG 100          HB1       ARG 100  12.795  15.629  15.824
  727   1HG   ARG 100          HG2       ARG 100  13.232  13.209  14.146
  728   2HG   ARG 100          HG1       ARG 100  12.168  14.489  13.561
  729   1HD   ARG 100          HD2       ARG 100  15.068  14.739  14.345
  730   2HD   ARG 100          HD1       ARG 100  14.389  14.873  12.724
  731    HE   ARG 100           HE       ARG 100  13.122  16.813  14.202
  732   1HH1  ARG 100          HH11      ARG 100  16.407  16.056  13.254
  733   2HH1  ARG 100          HH12      ARG 100  16.974  17.692  13.450
  734   1HH2  ARG 100          HH21      ARG 100  13.851  18.969  14.436
  735   2HH2  ARG 100          HH22      ARG 100  15.515  19.359  14.092
  736    H    TYR 101           HN       TYR 101  15.135  12.006  16.453
  737    HA   TYR 101           HA       TYR 101  17.279  13.897  17.140
  738   1HB   TYR 101          HB2       TYR 101  17.219  10.882  17.237
  739   2HB   TYR 101          HB1       TYR 101  18.643  11.855  17.585
  740    HD1  TYR 101           HD1      TYR 101  18.205  13.761  19.403
  741    HD2  TYR 101           HD2      TYR 101  15.947  10.184  19.012
  742    HE1  TYR 101           HE1      TYR 101  17.510  13.956  21.751
  743    HE2  TYR 101           HE2      TYR 101  15.241  10.367  21.363
  744    HH   TYR 101           HH       TYR 101  16.185  11.465  23.486
  745    H    VAL 102           HN       VAL 102  15.978  12.362  14.451
  746    HA   VAL 102           HA       VAL 102  18.429  11.967  13.020
  747    HB   VAL 102           HB       VAL 102  16.928  11.828  10.979
  748   1HG1  VAL 102          HG11      VAL 102  16.352   9.987  13.294
  749   2HG1  VAL 102          HG12      VAL 102  17.726   9.872  12.196
  750   3HG1  VAL 102          HG13      VAL 102  16.089   9.621  11.589
  751   1HG2  VAL 102          HG21      VAL 102  14.759  11.956  13.076
  752   2HG2  VAL 102          HG22      VAL 102  14.532  11.524  11.381
  753   3HG2  VAL 102          HG23      VAL 102  15.053  13.152  11.813
  Start of MODEL   10
    1   1H    MET   1          HT1       MET   1   4.004  -0.209  -2.434
    2   2H    MET   1          HT2       MET   1   3.947  -1.391  -3.644
    3   3H    MET   1          HT3       MET   1   4.499  -1.797  -2.098
    4    HA   MET   1           HA       MET   1   2.330  -1.380  -1.166
    5   1HB   MET   1          HB2       MET   1   1.685   0.350  -2.830
    6   2HB   MET   1          HB1       MET   1   1.496  -0.911  -4.038
    7   1HG   MET   1          HG2       MET   1  -0.303  -1.908  -2.747
    8   2HG   MET   1          HG1       MET   1  -0.092  -0.689  -1.490
    9   1HE   MET   1          HE1       MET   1  -2.652  -0.061  -1.585
   10   2HE   MET   1          HE2       MET   1  -2.905  -1.295  -2.820
   11   3HE   MET   1          HE3       MET   1  -3.511   0.342  -3.073
   12    H    THR   2           HN       THR   2   1.200  -3.211  -0.753
   13    HA   THR   2           HA       THR   2   0.696  -5.233  -2.689
   14    HB   THR   2           HB       THR   2   3.091  -5.712  -2.347
   15    HG1  THR   2           HG1      THR   2   2.792  -7.875  -2.113
   16   1HG2  THR   2          HG21      THR   2   2.326  -6.124   0.545
   17   2HG2  THR   2          HG22      THR   2   3.371  -4.853  -0.087
   18   3HG2  THR   2          HG23      THR   2   3.886  -6.538  -0.166
   19    H    MET   3           HN       MET   3  -0.091  -7.303  -1.456
   20    HA   MET   3           HA       MET   3  -2.089  -6.458   0.418
   21   1HB   MET   3          HB2       MET   3  -2.500  -8.241  -1.244
   22   2HB   MET   3          HB1       MET   3  -1.281  -9.240  -0.473
   23   1HG   MET   3          HG2       MET   3  -3.652  -8.275   1.074
   24   2HG   MET   3          HG1       MET   3  -3.779  -9.671   0.007
   25   1HE   MET   3          HE1       MET   3  -4.573 -11.148   2.076
   26   2HE   MET   3          HE2       MET   3  -4.430  -9.747   3.137
   27   3HE   MET   3          HE3       MET   3  -3.672 -11.275   3.586
   28    H    GLY   4           HN       GLY   4   1.024  -8.022   0.553
   29   1HA   GLY   4          HA2       GLY   4   2.452  -7.941   2.426
   30   2HA   GLY   4          HA1       GLY   4   1.054  -7.638   3.449
   31    H    CYS   5           HN       CYS   5  -0.260  -9.372   4.091
   32    HA   CYS   5           HA       CYS   5   0.046 -12.045   3.369
   33   1HB   CYS   5          HB2       CYS   5   1.315 -12.909   5.328
   34   2HB   CYS   5          HB1       CYS   5   2.301 -11.928   4.249
   35    H    ARG   6           HN       ARG   6  -0.752 -13.517   5.369
   36    HA   ARG   6           HA       ARG   6  -3.306 -12.445   6.012
   37   1HB   ARG   6          HB2       ARG   6  -3.730 -14.543   7.145
   38   2HB   ARG   6          HB1       ARG   6  -2.941 -14.841   5.604
   39   1HG   ARG   6          HG2       ARG   6  -0.791 -15.108   6.820
   40   2HG   ARG   6          HG1       ARG   6  -1.681 -14.953   8.336
   41   1HD   ARG   6          HD2       ARG   6  -2.053 -17.080   6.230
   42   2HD   ARG   6          HD1       ARG   6  -1.336 -17.289   7.828
   43    HE   ARG   6           HE       ARG   6  -3.646 -16.542   8.647
   44   1HH1  ARG   6          HH11      ARG   6  -3.068 -18.432   5.752
   45   2HH1  ARG   6          HH12      ARG   6  -4.641 -19.173   5.763
   46   1HH2  ARG   6          HH21      ARG   6  -5.724 -17.489   8.654
   47   2HH2  ARG   6          HH22      ARG   6  -6.149 -18.646   7.428
   48    H    HIS   7           HN       HIS   7  -0.284 -12.300   7.576
   49    HA   HIS   7           HA       HIS   7  -1.098 -12.010  10.258
   50   1HB   HIS   7          HB2       HIS   7   1.296 -10.821   8.840
   51   2HB   HIS   7          HB1       HIS   7   1.068 -10.836  10.583
   52    HD2  HIS   7           HD2      HIS   7   0.153 -13.989  10.852
   53    HE1  HIS   7           HE1      HIS   7   3.948 -14.682   9.120
   54    HE2  HIS   7           HE2      HIS   7   1.922 -15.768  10.187
   55    H    VAL   8           HN       VAL   8  -1.228  -9.860   7.537
   56    HA   VAL   8           HA       VAL   8  -1.415  -7.400   8.962
   57    HB   VAL   8           HB       VAL   8  -2.664  -7.956   6.278
   58   1HG1  VAL   8          HG11      VAL   8  -3.258  -5.822   7.256
   59   2HG1  VAL   8          HG12      VAL   8  -2.193  -5.586   5.870
   60   3HG1  VAL   8          HG13      VAL   8  -1.553  -5.442   7.507
   61   1HG2  VAL   8          HG21      VAL   8  -0.564  -7.345   5.249
   62   2HG2  VAL   8          HG22      VAL   8  -0.376  -8.771   6.269
   63   3HG2  VAL   8          HG23      VAL   8   0.185  -7.199   6.839
   64    H    ALA   9           HN       ALA   9  -3.631  -9.921   8.097
   65    HA   ALA   9           HA       ALA   9  -5.976  -8.387   8.602
   66   1HB   ALA   9          HB1       ALA   9  -7.181 -10.482   8.329
   67   2HB   ALA   9          HB2       ALA   9  -5.665 -11.380   8.402
   68   3HB   ALA   9          HB3       ALA   9  -5.981 -10.292   7.051
   69    H    GLY  10           HN       GLY  10  -3.673  -9.918  10.525
   70   1HA   GLY  10          HA2       GLY  10  -5.493 -10.466  12.736
   71   2HA   GLY  10          HA1       GLY  10  -3.782 -10.860  12.674
   72    H    ILE  11           HN       ILE  11  -3.137  -8.082  11.763
   73    HA   ILE  11           HA       ILE  11  -2.777  -7.013  14.402
   74    HB   ILE  11           HB       ILE  11  -1.596  -5.154  13.322
   75   1HG1  ILE  11          HG12      ILE  11  -2.277  -6.544  10.721
   76   2HG1  ILE  11          HG11      ILE  11  -3.001  -5.040  11.279
   77   1HG2  ILE  11          HG21      ILE  11   0.237  -6.488  12.342
   78   2HG2  ILE  11          HG22      ILE  11  -0.826  -7.896  12.339
   79   3HG2  ILE  11          HG23      ILE  11  -0.358  -7.147  13.865
   80   1HD1  ILE  11          HD11      ILE  11  -1.297  -4.590   9.643
   81   2HD1  ILE  11          HD12      ILE  11  -0.110  -5.485  10.589
   82   3HD1  ILE  11          HD13      ILE  11  -0.785  -3.982  11.217
   83    H    ARG  12           HN       ARG  12  -3.448  -4.960  15.134
   84    HA   ARG  12           HA       ARG  12  -5.816  -3.868  13.797
   85   1HB   ARG  12          HB2       ARG  12  -6.971  -3.690  15.979
   86   2HB   ARG  12          HB1       ARG  12  -6.693  -5.353  15.493
   87   1HG   ARG  12          HG2       ARG  12  -4.789  -3.970  17.339
   88   2HG   ARG  12          HG1       ARG  12  -6.293  -4.667  17.943
   89   1HD   ARG  12          HD2       ARG  12  -4.115  -6.126  16.451
   90   2HD   ARG  12          HD1       ARG  12  -4.463  -6.249  18.176
   91    HE   ARG  12           HE       ARG  12  -6.366  -7.100  16.086
   92   1HH1  ARG  12          HH11      ARG  12  -4.719  -7.598  19.129
   93   2HH1  ARG  12          HH12      ARG  12  -5.603  -9.050  19.512
   94   1HH2  ARG  12          HH21      ARG  12  -7.516  -9.000  16.564
   95   2HH2  ARG  12          HH22      ARG  12  -7.163  -9.873  18.033
   96    H    THR  13           HN       THR  13  -6.525  -1.889  15.461
   97    HA   THR  13           HA       THR  13  -4.326  -0.032  15.393
   98    HB   THR  13           HB       THR  13  -6.996   0.364  16.759
   99    HG1  THR  13           HG1      THR  13  -6.271   0.484  14.014
  100   1HG2  THR  13          HG21      THR  13  -5.058   2.303  15.485
  101   2HG2  THR  13          HG22      THR  13  -5.287   2.062  17.217
  102   3HG2  THR  13          HG23      THR  13  -6.596   2.725  16.239
  103    H    VAL  14           HN       VAL  14  -2.925   0.372  17.019
  104    HA   VAL  14           HA       VAL  14  -3.496  -0.887  19.617
  105    HB   VAL  14           HB       VAL  14  -1.012  -1.274  19.794
  106   1HG1  VAL  14          HG11      VAL  14  -1.046  -3.295  18.418
  107   2HG1  VAL  14          HG12      VAL  14  -2.466  -2.691  17.565
  108   3HG1  VAL  14          HG13      VAL  14  -2.568  -3.079  19.283
  109   1HG2  VAL  14          HG21      VAL  14   0.268  -1.351  17.695
  110   2HG2  VAL  14          HG22      VAL  14  -0.263   0.286  18.085
  111   3HG2  VAL  14          HG23      VAL  14  -1.105  -0.642  16.844
  112    H    THR  15           HN       THR  15  -2.609   0.072  21.460
  113    HA   THR  15           HA       THR  15  -2.235   2.956  21.209
  114    HB   THR  15           HB       THR  15  -2.679   1.195  23.630
  115    HG1  THR  15           HG1      THR  15  -4.394   1.921  21.884
  116   1HG2  THR  15          HG21      THR  15  -2.991   3.273  24.884
  117   2HG2  THR  15          HG22      THR  15  -2.559   4.208  23.453
  118   3HG2  THR  15          HG23      THR  15  -1.358   3.172  24.224
  119    HA   PRO  16           HA       PRO  16   2.203   2.547  21.543
  120   1HB   PRO  16          HB2       PRO  16   1.970   5.358  22.457
  121   2HB   PRO  16          HB1       PRO  16   2.936   4.677  21.144
  122   1HG   PRO  16          HG2       PRO  16   0.742   6.097  20.625
  123   2HG   PRO  16          HG1       PRO  16   1.155   4.666  19.661
  124   1HD   PRO  16          HD2       PRO  16  -0.877   4.964  21.836
  125   2HD   PRO  16          HD1       PRO  16  -0.982   4.062  20.310
  126    H    SER  17           HN       SER  17   3.363   1.804  23.178
  127    HA   SER  17           HA       SER  17   2.424   1.825  25.847
  128   1HB   SER  17          HB2       SER  17   3.867   0.045  24.767
  129   2HB   SER  17          HB1       SER  17   5.230   1.150  24.935
  130    HG   SER  17           HG       SER  17   5.119   0.988  27.117
  131    H    ALA  18           HN       ALA  18   4.868   3.699  24.138
  132    HA   ALA  18           HA       ALA  18   4.859   5.640  26.312
  133   1HB   ALA  18          HB1       ALA  18   7.274   5.759  26.437
  134   2HB   ALA  18          HB2       ALA  18   7.426   4.499  25.213
  135   3HB   ALA  18          HB3       ALA  18   6.742   4.115  26.793
  136    H    LEU  19           HN       LEU  19   6.208   7.619  25.610
  137    HA   LEU  19           HA       LEU  19   5.266   8.582  23.128
  138   1HB   LEU  19          HB2       LEU  19   7.581   9.601  24.785
  139   2HB   LEU  19          HB1       LEU  19   6.777  10.484  23.502
  140    HG   LEU  19           HG       LEU  19   5.516   9.650  26.116
  141   1HD1  LEU  19          HD11      LEU  19   5.540  12.028  26.635
  142   2HD1  LEU  19          HD12      LEU  19   6.364  12.364  25.113
  143   3HD1  LEU  19          HD13      LEU  19   7.176  11.427  26.367
  144   1HD2  LEU  19          HD21      LEU  19   3.906   9.692  24.281
  145   2HD2  LEU  19          HD22      LEU  19   4.426  11.323  23.856
  146   3HD2  LEU  19          HD23      LEU  19   3.630  11.026  25.402
  147    H    GLY  20           HN       GLY  20   8.487   7.535  24.166
  148   1HA   GLY  20          HA2       GLY  20   9.171   7.121  21.333
  149   2HA   GLY  20          HA1       GLY  20  10.330   7.733  22.504
  150    H    CYS  21           HN       CYS  21  11.612   5.904  21.730
  151    HA   CYS  21           HA       CYS  21  10.830   3.222  22.204
  152   1HB   CYS  21          HB2       CYS  21  12.619   3.890  20.621
  153   2HB   CYS  21          HB1       CYS  21  13.614   4.391  21.981
  154    HG   CYS  21           HG       CYS  21  14.849   2.147  21.896
  155    H    GLU  22           HN       GLU  22  10.438   2.393  24.150
  156    HA   GLU  22           HA       GLU  22  11.142   3.640  26.574
  157   1HB   GLU  22          HB2       GLU  22  10.538   0.704  26.445
  158   2HB   GLU  22          HB1       GLU  22  10.058   1.879  27.659
  159   1HG   GLU  22          HG2       GLU  22   8.067   1.514  26.609
  160   2HG   GLU  22          HG1       GLU  22   8.666   2.891  25.683
  161    H    GLU  23           HN       GLU  23  12.672   1.209  24.634
  162    HA   GLU  23           HA       GLU  23  14.584   0.171  26.361
  163   1HB   GLU  23          HB2       GLU  23  14.085  -0.487  23.951
  164   2HB   GLU  23          HB1       GLU  23  15.071   0.885  23.469
  165   1HG   GLU  23          HG2       GLU  23  16.339  -1.162  23.362
  166   2HG   GLU  23          HG1       GLU  23  16.993  -0.091  24.600
  167    H    CYS  24           HN       CYS  24  14.857   2.977  24.196
  168    HA   CYS  24           HA       CYS  24  17.371   3.829  25.160
  169   1HB   CYS  24          HB2       CYS  24  15.200   5.408  23.764
  170   2HB   CYS  24          HB1       CYS  24  16.875   5.915  23.950
  171    HG   CYS  24           HG       CYS  24  17.389   5.083  21.587
  172    H    LEU  25           HN       LEU  25  14.053   4.531  26.071
  173    HA   LEU  25           HA       LEU  25  14.599   6.760  27.722
  174   1HB   LEU  25          HB2       LEU  25  12.279   4.834  27.753
  175   2HB   LEU  25          HB1       LEU  25  12.339   6.333  28.659
  176    HG   LEU  25           HG       LEU  25  12.381   6.092  25.648
  177   1HD1  LEU  25          HD11      LEU  25  10.235   7.085  27.518
  178   2HD1  LEU  25          HD12      LEU  25  10.208   5.561  26.632
  179   3HD1  LEU  25          HD13      LEU  25  10.164   7.092  25.756
  180   1HD2  LEU  25          HD21      LEU  25  13.678   8.006  26.425
  181   2HD2  LEU  25          HD22      LEU  25  12.319   8.535  27.418
  182   3HD2  LEU  25          HD23      LEU  25  12.178   8.527  25.660
  183    H    LYS  26           HN       LYS  26  15.162   3.423  28.213
  184    HA   LYS  26           HA       LYS  26  14.821   3.319  31.028
  185   1HB   LYS  26          HB2       LYS  26  15.578   1.166  30.882
  186   2HB   LYS  26          HB1       LYS  26  15.200   1.423  29.186
  187   1HG   LYS  26          HG2       LYS  26  17.664   2.157  28.979
  188   2HG   LYS  26          HG1       LYS  26  17.872   1.350  30.532
  189   1HD   LYS  26          HD2       LYS  26  16.903   0.124  27.952
  190   2HD   LYS  26          HD1       LYS  26  18.434  -0.187  28.770
  191   1HE   LYS  26          HE2       LYS  26  17.239  -1.186  30.644
  192   2HE   LYS  26          HE1       LYS  26  15.697  -0.839  29.860
  193   1HZ   LYS  26          HZ1       LYS  26  16.169  -3.074  29.380
  194   2HZ   LYS  26          HZ2       LYS  26  17.790  -2.758  29.009
  195   3HZ   LYS  26          HZ3       LYS  26  16.566  -2.240  27.954
  196    H    ILE  27           HN       ILE  27  17.306   4.553  28.970
  197    HA   ILE  27           HA       ILE  27  18.951   5.135  31.343
  198    HB   ILE  27           HB       ILE  27  20.932   5.140  29.790
  199   1HG1  ILE  27          HG12      ILE  27  18.978   3.740  27.949
  200   2HG1  ILE  27          HG11      ILE  27  19.707   5.317  27.670
  201   1HG2  ILE  27          HG21      ILE  27  19.454   2.543  30.190
  202   2HG2  ILE  27          HG22      ILE  27  20.552   3.318  31.334
  203   3HG2  ILE  27          HG23      ILE  27  21.169   2.687  29.807
  204   1HD1  ILE  27          HD11      ILE  27  21.164   2.690  27.812
  205   2HD1  ILE  27          HD12      ILE  27  21.911   4.267  27.554
  206   3HD1  ILE  27          HD13      ILE  27  20.801   3.609  26.352
  207    H    GLY  28           HN       GLY  28  17.165   6.420  28.800
  208   1HA   GLY  28          HA2       GLY  28  16.742   8.698  28.423
  209   2HA   GLY  28          HA1       GLY  28  18.200   9.095  29.325
  210    H    SER  29           HN       SER  29  18.197   6.705  26.819
  211    HA   SER  29           HA       SER  29  20.257   8.163  25.403
  212   1HB   SER  29          HB2       SER  29  20.368   5.697  25.902
  213   2HB   SER  29          HB1       SER  29  19.040   5.462  24.771
  214    HG   SER  29           HG       SER  29  21.589   6.570  24.165
  215    HA   PRO  30           HA       PRO  30  17.579   9.597  22.110
  216   1HB   PRO  30          HB2       PRO  30  19.871   9.452  20.302
  217   2HB   PRO  30          HB1       PRO  30  19.009  10.872  20.898
  218   1HG   PRO  30          HG2       PRO  30  21.526  10.282  21.672
  219   2HG   PRO  30          HG1       PRO  30  20.362  11.082  22.745
  220   1HD   PRO  30          HD2       PRO  30  21.179   8.198  22.650
  221   2HD   PRO  30          HD1       PRO  30  20.935   9.252  24.061
  222    H    TRP  31           HN       TRP  31  17.535   9.110  19.554
  223    HA   TRP  31           HA       TRP  31  17.997   6.361  18.868
  224   1HB   TRP  31          HB2       TRP  31  15.602   5.887  18.350
  225   2HB   TRP  31          HB1       TRP  31  15.921   6.053  20.071
  226    HD1  TRP  31           HD1      TRP  31  14.393   8.096  17.151
  227    HE1  TRP  31           HE1      TRP  31  12.632   9.695  18.136
  228    HE3  TRP  31           HE3      TRP  31  15.110   7.127  22.123
  229    HZ2  TRP  31           HZ2      TRP  31  11.676  10.443  20.686
  230    HZ3  TRP  31           HZ3      TRP  31  13.730   8.325  23.768
  231    HH2  TRP  31           HH2      TRP  31  12.049   9.949  23.064
  232    H    VAL  32           HN       VAL  32  16.794   6.013  16.590
  233    HA   VAL  32           HA       VAL  32  17.338   8.444  15.031
  234    HB   VAL  32           HB       VAL  32  17.230   5.584  14.049
  235   1HG1  VAL  32          HG11      VAL  32  18.100   6.442  11.964
  236   2HG1  VAL  32          HG12      VAL  32  18.145   8.076  12.623
  237   3HG1  VAL  32          HG13      VAL  32  16.596   7.275  12.361
  238   1HG2  VAL  32          HG21      VAL  32  19.159   5.936  15.476
  239   2HG2  VAL  32          HG22      VAL  32  19.590   7.387  14.572
  240   3HG2  VAL  32          HG23      VAL  32  19.668   5.807  13.793
  241    H    HIS  33           HN       HIS  33  15.308   5.570  14.387
  242    HA   HIS  33           HA       HIS  33  12.963   7.318  14.339
  243   1HB   HIS  33          HB2       HIS  33  13.806   5.524  12.064
  244   2HB   HIS  33          HB1       HIS  33  12.168   6.146  12.241
  245    HD1  HIS  33           HD1      HIS  33  12.342   9.007  12.688
  246    HD2  HIS  33           HD2      HIS  33  15.176   7.057  10.330
  247    HE1  HIS  33           HE1      HIS  33  13.366  10.787  11.230
  248    HE2  HIS  33           HE2      HIS  33  15.005   9.575   9.744
  249    H    LEU  34           HN       LEU  34  11.260   6.487  15.253
  250    HA   LEU  34           HA       LEU  34  11.464   3.891  16.497
  251   1HB   LEU  34          HB2       LEU  34   9.254   5.931  16.687
  252   2HB   LEU  34          HB1       LEU  34   9.527   4.575  17.764
  253    HG   LEU  34           HG       LEU  34  11.402   6.915  17.443
  254   1HD1  LEU  34          HD11      LEU  34  10.603   7.597  19.644
  255   2HD1  LEU  34          HD12      LEU  34   9.437   6.274  19.635
  256   3HD1  LEU  34          HD13      LEU  34   9.294   7.584  18.463
  257   1HD2  LEU  34          HD21      LEU  34  12.480   6.003  19.437
  258   2HD2  LEU  34          HD22      LEU  34  12.524   4.854  18.099
  259   3HD2  LEU  34          HD23      LEU  34  11.368   4.634  19.413
  260    H    ARG  35           HN       ARG  35  10.317   2.135  16.065
  261    HA   ARG  35           HA       ARG  35   8.218   2.254  13.996
  262   1HB   ARG  35          HB2       ARG  35   9.892  -0.109  14.901
  263   2HB   ARG  35          HB1       ARG  35   8.686  -0.135  13.624
  264   1HG   ARG  35          HG2       ARG  35  11.139   1.599  13.525
  265   2HG   ARG  35          HG1       ARG  35  11.084  -0.042  12.877
  266   1HD   ARG  35          HD2       ARG  35   9.298   0.587  11.366
  267   2HD   ARG  35          HD1       ARG  35   9.254   2.202  12.063
  268    HE   ARG  35           HE       ARG  35  11.170   2.756  10.889
  269   1HH1  ARG  35          HH11      ARG  35  10.464  -0.648  10.505
  270   2HH1  ARG  35          HH12      ARG  35  11.582  -0.873   9.196
  271   1HH2  ARG  35          HH21      ARG  35  12.627   2.484   9.143
  272   2HH2  ARG  35          HH22      ARG  35  12.811   0.911   8.414
  273    H    ILE  36           HN       ILE  36   6.169   1.697  14.631
  274    HA   ILE  36           HA       ILE  36   5.868   0.815  17.421
  275    HB   ILE  36           HB       ILE  36   4.616   2.829  16.833
  276   1HG1  ILE  36          HG12      ILE  36   2.738   0.494  17.240
  277   2HG1  ILE  36          HG11      ILE  36   3.755   1.171  18.507
  278   1HG2  ILE  36          HG21      ILE  36   4.252   2.427  14.467
  279   2HG2  ILE  36          HG22      ILE  36   2.720   2.740  15.283
  280   3HG2  ILE  36          HG23      ILE  36   3.165   1.090  14.843
  281   1HD1  ILE  36          HD11      ILE  36   2.602   3.299  18.306
  282   2HD1  ILE  36          HD12      ILE  36   1.472   1.988  18.650
  283   3HD1  ILE  36          HD13      ILE  36   1.595   2.640  17.016
  284    H    CYS  37           HN       CYS  37   5.274  -1.100  17.937
  285    HA   CYS  37           HA       CYS  37   4.967  -3.136  15.954
  286   1HB   CYS  37          HB2       CYS  37   6.145  -3.522  18.048
  287   2HB   CYS  37          HB1       CYS  37   4.686  -3.159  18.956
  288    H    ARG  38           HN       ARG  38   3.109  -3.528  14.914
  289    HA   ARG  38           HA       ARG  38   0.657  -2.320  15.741
  290   1HB   ARG  38          HB2       ARG  38   1.253  -4.285  13.529
  291   2HB   ARG  38          HB1       ARG  38  -0.299  -3.497  13.761
  292   1HG   ARG  38          HG2       ARG  38   2.306  -2.106  13.183
  293   2HG   ARG  38          HG1       ARG  38   1.016  -2.417  12.020
  294   1HD   ARG  38          HD2       ARG  38   0.904  -0.642  14.452
  295   2HD   ARG  38          HD1       ARG  38   0.829  -0.152  12.759
  296    HE   ARG  38           HE       ARG  38  -1.278  -1.792  14.006
  297   1HH1  ARG  38          HH11      ARG  38  -0.252   0.955  12.091
  298   2HH1  ARG  38          HH12      ARG  38  -1.874   1.452  11.712
  299   1HH2  ARG  38          HH21      ARG  38  -3.401  -1.135  13.535
  300   2HH2  ARG  38          HH22      ARG  38  -3.675   0.266  12.540
  301    H    THR  39           HN       THR  39   2.081  -5.017  16.930
  302    HA   THR  39           HA       THR  39  -0.365  -6.602  17.057
  303    HB   THR  39           HB       THR  39   2.237  -7.431  18.295
  304    HG1  THR  39           HG1      THR  39   1.745  -8.207  15.657
  305   1HG2  THR  39          HG21      THR  39   1.428  -9.666  17.661
  306   2HG2  THR  39          HG22      THR  39  -0.014  -8.936  16.954
  307   3HG2  THR  39          HG23      THR  39   0.273  -8.821  18.690
  308    H    CYS  40           HN       CYS  40   1.658  -4.610  19.105
  309    HA   CYS  40           HA       CYS  40  -0.178  -5.089  21.321
  310   1HB   CYS  40          HB2       CYS  40   1.528  -5.695  22.898
  311   2HB   CYS  40          HB1       CYS  40   1.708  -6.737  21.494
  312    H    GLY  41           HN       GLY  41   1.374  -2.899  19.460
  313   1HA   GLY  41          HA2       GLY  41   1.475  -0.613  19.622
  314   2HA   GLY  41          HA1       GLY  41   0.672  -0.747  21.176
  315    H    HIS  42           HN       HIS  42   3.652  -2.477  20.741
  316    HA   HIS  42           HA       HIS  42   4.848  -0.715  22.728
  317   1HB   HIS  42          HB2       HIS  42   4.907  -3.281  22.863
  318   2HB   HIS  42          HB1       HIS  42   6.116  -3.205  21.585
  319    HD1  HIS  42           HD1      HIS  42   5.647  -2.731  25.224
  320    HD2  HIS  42           HD2      HIS  42   8.578  -1.984  22.375
  321    HE1  HIS  42           HE1      HIS  42   7.745  -2.268  26.519
  322    HE2  HIS  42           HE2      HIS  42   9.367  -1.460  24.774
  323    H    VAL  43           HN       VAL  43   6.658   0.534  22.379
  324    HA   VAL  43           HA       VAL  43   7.109   1.159  19.566
  325    HB   VAL  43           HB       VAL  43   8.076   2.622  22.030
  326   1HG1  VAL  43          HG11      VAL  43   8.454   4.493  20.514
  327   2HG1  VAL  43          HG12      VAL  43   7.925   3.508  19.150
  328   3HG1  VAL  43          HG13      VAL  43   9.399   3.087  20.023
  329   1HG2  VAL  43          HG21      VAL  43   5.625   2.549  21.913
  330   2HG2  VAL  43          HG22      VAL  43   5.689   3.212  20.280
  331   3HG2  VAL  43          HG23      VAL  43   6.244   4.178  21.647
  332    H    GLY  44           HN       GLY  44   8.918   0.660  18.492
  333   1HA   GLY  44          HA2       GLY  44  11.333   0.040  20.054
  334   2HA   GLY  44          HA1       GLY  44  10.759  -1.111  18.856
  335    H    CYS  45           HN       CYS  45  13.022   1.153  19.308
  336    HA   CYS  45           HA       CYS  45  12.868   2.570  16.837
  337   1HB   CYS  45          HB2       CYS  45  14.203   3.193  18.972
  338   2HB   CYS  45          HB1       CYS  45  15.426   2.088  18.353
  339    HG   CYS  45           HG       CYS  45  16.308   3.577  16.365
  340    H    CYS  46           HN       CYS  46  14.001   2.174  14.926
  341    HA   CYS  46           HA       CYS  46  13.892  -0.518  14.151
  342   1HB   CYS  46          HB2       CYS  46  13.634   1.612  12.727
  343   2HB   CYS  46          HB1       CYS  46  15.389   1.591  12.610
  344    HG   CYS  46           HG       CYS  46  15.482  -0.936  11.340
  345    H    ASP  47           HN       ASP  47  15.630  -1.700  13.035
  346    HA   ASP  47           HA       ASP  47  17.787  -2.259  14.752
  347   1HB   ASP  47          HB2       ASP  47  18.522  -3.797  13.006
  348   2HB   ASP  47          HB1       ASP  47  16.777  -3.906  13.214
  349    H    ASP  48           HN       ASP  48  17.394   0.113  12.377
  350    HA   ASP  48           HA       ASP  48  20.044   0.519  11.529
  351   1HB   ASP  48          HB2       ASP  48  18.282   1.580  10.326
  352   2HB   ASP  48          HB1       ASP  48  17.662   2.355  11.779
  353    H    SER  49           HN       SER  49  18.289   1.463  14.394
  354    HA   SER  49           HA       SER  49  20.466   3.093  15.413
  355   1HB   SER  49          HB2       SER  49  18.009   2.130  16.891
  356   2HB   SER  49          HB1       SER  49  19.028   3.514  17.284
  357    HG   SER  49           HG       SER  49  18.022   3.641  14.750
  358    HA   PRO  50           HA       PRO  50  22.848  -0.145  17.207
  359   1HB   PRO  50          HB2       PRO  50  23.400   1.038  19.677
  360   2HB   PRO  50          HB1       PRO  50  24.337   1.242  18.195
  361   1HG   PRO  50          HG2       PRO  50  22.245   3.010  19.377
  362   2HG   PRO  50          HG1       PRO  50  23.739   3.447  18.526
  363   1HD   PRO  50          HD2       PRO  50  21.364   3.621  17.318
  364   2HD   PRO  50          HD1       PRO  50  22.801   3.066  16.432
  365    H    HIS  51           HN       HIS  51  20.291   1.253  19.196
  366    HA   HIS  51           HA       HIS  51  20.210  -0.783  21.148
  367   1HB   HIS  51          HB2       HIS  51  18.142   1.215  20.242
  368   2HB   HIS  51          HB1       HIS  51  17.832   0.060  21.531
  369    HD1  HIS  51           HD1      HIS  51  18.787   0.580  23.832
  370    HD2  HIS  51           HD2      HIS  51  20.106   3.204  20.881
  371    HE1  HIS  51           HE1      HIS  51  19.813   2.513  25.052
  372    HE2  HIS  51           HE2      HIS  51  20.844   3.948  23.248
  373    H    LYS  52           HN       LYS  52  18.686  -0.453  17.999
  374    HA   LYS  52           HA       LYS  52  17.326  -1.804  16.761
  375   1HB   LYS  52          HB2       LYS  52  19.054  -3.898  18.091
  376   2HB   LYS  52          HB1       LYS  52  18.085  -4.152  16.647
  377   1HG   LYS  52          HG2       LYS  52  19.410  -2.565  15.419
  378   2HG   LYS  52          HG1       LYS  52  20.320  -2.151  16.872
  379   1HD   LYS  52          HD2       LYS  52  20.258  -4.889  15.610
  380   2HD   LYS  52          HD1       LYS  52  21.524  -3.689  15.342
  381   1HE   LYS  52          HE2       LYS  52  21.896  -3.672  17.822
  382   2HE   LYS  52          HE1       LYS  52  20.792  -5.043  17.930
  383   1HZ   LYS  52          HZ1       LYS  52  23.349  -4.951  16.423
  384   2HZ   LYS  52          HZ2       LYS  52  22.274  -6.261  16.419
  385   3HZ   LYS  52          HZ3       LYS  52  23.054  -5.813  17.856
  386    H    HIS  53           HN       HIS  53  15.734  -1.057  18.692
  387    HA   HIS  53           HA       HIS  53  14.977  -3.229  20.424
  388   1HB   HIS  53          HB2       HIS  53  14.880  -0.750  21.042
  389   2HB   HIS  53          HB1       HIS  53  13.412  -0.679  20.068
  390    HD1  HIS  53           HD1      HIS  53  11.708  -0.366  21.945
  391    HD2  HIS  53           HD2      HIS  53  14.240  -3.610  22.548
  392    HE1  HIS  53           HE1      HIS  53  10.792  -1.583  23.939
  393    HE2  HIS  53           HE2      HIS  53  12.455  -3.424  24.401
  394    H    ALA  54           HN       ALA  54  13.939  -1.977  17.358
  395    HA   ALA  54           HA       ALA  54  11.341  -3.119  17.350
  396   1HB   ALA  54          HB1       ALA  54  11.999  -1.362  15.772
  397   2HB   ALA  54          HB2       ALA  54  11.396  -2.789  14.930
  398   3HB   ALA  54          HB3       ALA  54  13.129  -2.476  15.003
  399    H    THR  55           HN       THR  55  14.488  -4.282  16.212
  400    HA   THR  55           HA       THR  55  13.513  -6.756  15.205
  401    HB   THR  55           HB       THR  55  16.012  -7.369  15.330
  402    HG1  THR  55           HG1      THR  55  17.220  -5.983  16.373
  403   1HG2  THR  55          HG21      THR  55  14.908  -6.627  13.275
  404   2HG2  THR  55          HG22      THR  55  16.541  -5.968  13.391
  405   3HG2  THR  55          HG23      THR  55  15.149  -4.946  13.748
  406    H    ARG  56           HN       ARG  56  15.268  -5.857  18.174
  407    HA   ARG  56           HA       ARG  56  15.420  -8.429  19.271
  408   1HB   ARG  56          HB2       ARG  56  15.348  -5.735  20.630
  409   2HB   ARG  56          HB1       ARG  56  15.702  -7.243  21.462
  410   1HG   ARG  56          HG2       ARG  56  17.649  -7.580  20.022
  411   2HG   ARG  56          HG1       ARG  56  17.298  -6.058  19.202
  412   1HD   ARG  56          HD2       ARG  56  19.037  -5.760  20.878
  413   2HD   ARG  56          HD1       ARG  56  17.587  -4.853  21.307
  414    HE   ARG  56           HE       ARG  56  17.456  -7.367  22.545
  415   1HH1  ARG  56          HH11      ARG  56  19.366  -4.435  22.695
  416   2HH1  ARG  56          HH12      ARG  56  19.747  -4.612  24.377
  417   1HH2  ARG  56          HH21      ARG  56  17.941  -7.592  24.774
  418   2HH2  ARG  56          HH22      ARG  56  18.942  -6.404  25.562
  419    H    HIS  57           HN       HIS  57  12.884  -5.988  19.464
  420    HA   HIS  57           HA       HIS  57  11.309  -7.318  21.401
  421   1HB   HIS  57          HB2       HIS  57  10.918  -4.970  20.899
  422   2HB   HIS  57          HB1       HIS  57  10.499  -5.364  19.235
  423    HD1  HIS  57           HD1      HIS  57   9.155  -5.721  22.764
  424    HD2  HIS  57           HD2      HIS  57   7.918  -6.132  18.808
  425    HE1  HIS  57           HE1      HIS  57   6.646  -6.074  22.824
  426    H    PHE  58           HN       PHE  58  11.372  -7.410  17.869
  427    HA   PHE  58           HA       PHE  58   9.169  -9.086  17.466
  428   1HB   PHE  58          HB2       PHE  58  10.044  -8.041  15.546
  429   2HB   PHE  58          HB1       PHE  58  11.681  -8.592  15.884
  430    HD1  PHE  58           HD1      PHE  58   8.344 -10.227  15.441
  431    HD2  PHE  58           HD2      PHE  58  12.455 -10.113  14.392
  432    HE1  PHE  58           HE1      PHE  58   8.015 -12.165  13.965
  433    HE2  PHE  58           HE2      PHE  58  12.133 -12.043  12.908
  434    HZ   PHE  58           HZ       PHE  58   9.915 -13.076  12.697
  435    H    HIS  59           HN       HIS  59  12.580  -9.856  18.041
  436    HA   HIS  59           HA       HIS  59  12.258 -12.657  17.731
  437   1HB   HIS  59          HB2       HIS  59  14.434 -11.342  17.603
  438   2HB   HIS  59          HB1       HIS  59  14.409 -11.301  19.362
  439    HD1  HIS  59           HD1      HIS  59  15.432 -13.363  16.531
  440    HD2  HIS  59           HD2      HIS  59  14.569 -13.966  20.555
  441    HE1  HIS  59           HE1      HIS  59  16.391 -15.618  17.102
  442    HE2  HIS  59           HE2      HIS  59  15.967 -15.908  19.570
  443    H    ALA  60           HN       ALA  60  11.886 -10.474  20.434
  444    HA   ALA  60           HA       ALA  60  11.869 -12.543  22.422
  445   1HB   ALA  60          HB1       ALA  60  10.968  -9.676  22.650
  446   2HB   ALA  60          HB2       ALA  60  12.611 -10.256  22.922
  447   3HB   ALA  60          HB3       ALA  60  11.303 -10.780  23.984
  448    H    THR  61           HN       THR  61   9.314 -10.356  21.192
  449    HA   THR  61           HA       THR  61   7.310 -11.890  22.613
  450    HB   THR  61           HB       THR  61   5.705 -10.241  21.535
  451    HG1  THR  61           HG1      THR  61   8.186  -9.225  20.605
  452   1HG2  THR  61          HG21      THR  61   7.921  -9.088  23.231
  453   2HG2  THR  61          HG22      THR  61   6.526  -9.982  23.834
  454   3HG2  THR  61          HG23      THR  61   6.296  -8.422  23.041
  455    H    GLY  62           HN       GLY  62   8.608 -11.812  19.428
  456   1HA   GLY  62          HA2       GLY  62   8.088 -13.106  17.583
  457   2HA   GLY  62          HA1       GLY  62   6.809 -13.865  18.525
  458    H    HIS  63           HN       HIS  63   7.374 -10.472  17.691
  459    HA   HIS  63           HA       HIS  63   4.689 -10.420  16.475
  460   1HB   HIS  63          HB2       HIS  63   6.121  -8.294  18.082
  461   2HB   HIS  63          HB1       HIS  63   4.671  -7.976  17.138
  462    HD2  HIS  63           HD2      HIS  63   3.604 -11.136  18.397
  463    HE1  HIS  63           HE1      HIS  63   3.009  -8.531  21.683
  464    HE2  HIS  63           HE2      HIS  63   2.221 -10.667  20.548
  465    HA   PRO  64           HA       PRO  64   7.604  -9.733  13.170
  466   1HB   PRO  64          HB2       PRO  64   6.039 -10.508  11.139
  467   2HB   PRO  64          HB1       PRO  64   6.695 -11.659  12.309
  468   1HG   PRO  64          HG2       PRO  64   3.957 -10.460  12.162
  469   2HG   PRO  64          HG1       PRO  64   4.428 -12.134  12.504
  470   1HD   PRO  64          HD2       PRO  64   3.758 -10.303  14.435
  471   2HD   PRO  64          HD1       PRO  64   4.820 -11.697  14.715
  472    H    ILE  65           HN       ILE  65   4.586  -8.000  13.490
  473    HA   ILE  65           HA       ILE  65   5.267  -6.423  11.106
  474    HB   ILE  65           HB       ILE  65   2.591  -6.741  12.461
  475   1HG1  ILE  65          HG12      ILE  65   3.666  -7.596   9.764
  476   2HG1  ILE  65          HG11      ILE  65   3.233  -8.654  11.101
  477   1HG2  ILE  65          HG21      ILE  65   1.704  -5.338  10.644
  478   2HG2  ILE  65          HG22      ILE  65   3.348  -5.040  10.083
  479   3HG2  ILE  65          HG23      ILE  65   2.837  -4.454  11.666
  480   1HD1  ILE  65          HD11      ILE  65   1.550  -8.647   9.326
  481   2HD1  ILE  65          HD12      ILE  65   1.314  -6.916   9.566
  482   3HD1  ILE  65          HD13      ILE  65   0.902  -8.049  10.853
  483    H    ILE  66           HN       ILE  66   5.996  -4.487  11.293
  484    HA   ILE  66           HA       ILE  66   5.302  -2.875  13.661
  485    HB   ILE  66           HB       ILE  66   7.471  -1.695  13.372
  486   1HG1  ILE  66          HG12      ILE  66   8.132  -3.969  11.485
  487   2HG1  ILE  66          HG11      ILE  66   7.801  -2.313  10.985
  488   1HG2  ILE  66          HG21      ILE  66   7.226  -3.449  15.050
  489   2HG2  ILE  66          HG22      ILE  66   8.860  -3.429  14.386
  490   3HG2  ILE  66          HG23      ILE  66   7.712  -4.661  13.864
  491   1HD1  ILE  66          HD11      ILE  66   9.749  -1.543  12.217
  492   2HD1  ILE  66          HD12      ILE  66  10.186  -2.780  11.036
  493   3HD1  ILE  66          HD13      ILE  66  10.073  -3.193  12.747
  494    H    GLU  67           HN       GLU  67   5.309  -0.536  13.232
  495    HA   GLU  67           HA       GLU  67   4.672   0.124  10.437
  496   1HB   GLU  67          HB2       GLU  67   2.747  -0.298  12.281
  497   2HB   GLU  67          HB1       GLU  67   3.073   1.400  12.588
  498   1HG   GLU  67          HG2       GLU  67   2.699   0.664   9.766
  499   2HG   GLU  67          HG1       GLU  67   1.282   0.497  10.800
  500    H    GLY  68           HN       GLY  68   4.507   2.614  10.213
  501   1HA   GLY  68          HA2       GLY  68   6.995   3.666  11.275
  502   2HA   GLY  68          HA1       GLY  68   5.967   4.424  10.068
  503    H    TYR  69           HN       TYR  69   6.880   4.337  13.333
  504    HA   TYR  69           HA       TYR  69   4.463   5.656  14.274
  505   1HB   TYR  69          HB2       TYR  69   5.505   3.815  15.586
  506   2HB   TYR  69          HB1       TYR  69   6.921   4.835  15.830
  507    HD1  TYR  69           HD1      TYR  69   7.014   5.579  18.013
  508    HD2  TYR  69           HD2      TYR  69   3.245   5.440  16.045
  509    HE1  TYR  69           HE1      TYR  69   5.948   6.584  19.989
  510    HE2  TYR  69           HE2      TYR  69   2.173   6.441  18.012
  511    HH   TYR  69           HH       TYR  69   4.042   7.661  20.702
  512    H    ASP  70           HN       ASP  70   7.963   6.259  14.623
  513    HA   ASP  70           HA       ASP  70   7.622   8.936  15.453
  514   1HB   ASP  70          HB2       ASP  70   9.633   7.975  16.132
  515   2HB   ASP  70          HB1       ASP  70   9.980   7.336  14.535
  516    HA   PRO  71           HA       PRO  71   8.170  10.281  10.970
  517   1HB   PRO  71          HB2       PRO  71   8.708   8.215   9.114
  518   2HB   PRO  71          HB1       PRO  71   9.855   9.408   9.725
  519   1HG   PRO  71          HG2       PRO  71   9.943   6.657  10.204
  520   2HG   PRO  71          HG1       PRO  71  10.831   7.898  11.103
  521   1HD   PRO  71          HD2       PRO  71   8.281   6.506  11.800
  522   2HD   PRO  71          HD1       PRO  71   9.606   7.036  12.854
  523    HA   PRO  72           HA       PRO  72   3.945   8.707  10.524
  524   1HB   PRO  72          HB2       PRO  72   2.873  11.060   9.678
  525   2HB   PRO  72          HB1       PRO  72   3.175  10.688  11.379
  526   1HG   PRO  72          HG2       PRO  72   4.786  12.341   9.484
  527   2HG   PRO  72          HG1       PRO  72   4.424  12.626  11.196
  528   1HD   PRO  72          HD2       PRO  72   6.799  11.627  10.318
  529   2HD   PRO  72          HD1       PRO  72   6.114  11.248  11.910
  530    H    GLU  73           HN       GLU  73   4.705   7.394   8.753
  531    HA   GLU  73           HA       GLU  73   4.229   8.607   6.113
  532   1HB   GLU  73          HB2       GLU  73   5.873   6.152   6.748
  533   2HB   GLU  73          HB1       GLU  73   5.712   6.931   5.179
  534   1HG   GLU  73          HG2       GLU  73   6.836   8.914   6.035
  535   2HG   GLU  73          HG1       GLU  73   6.975   8.158   7.622
  536    H    GLY  74           HN       GLY  74   3.667   5.783   8.161
  537   1HA   GLY  74          HA2       GLY  74   1.722   4.527   8.279
  538   2HA   GLY  74          HA1       GLY  74   1.109   5.394   6.879
  539    H    TRP  75           HN       TRP  75   3.425   2.900   7.855
  540    HA   TRP  75           HA       TRP  75   2.568   1.230   5.688
  541   1HB   TRP  75          HB2       TRP  75   4.820   0.901   4.700
  542   2HB   TRP  75          HB1       TRP  75   4.189   2.520   4.437
  543    HD1  TRP  75           HD1      TRP  75   5.388   4.532   5.782
  544    HE1  TRP  75           HE1      TRP  75   7.766   4.736   6.750
  545    HE3  TRP  75           HE3      TRP  75   6.670  -0.419   5.821
  546    HZ2  TRP  75           HZ2      TRP  75   9.896   3.020   7.437
  547    HZ3  TRP  75           HZ3      TRP  75   8.900  -1.048   6.648
  548    HH2  TRP  75           HH2      TRP  75  10.475   0.635   7.438
  549    H    GLY  76           HN       GLY  76   3.164  -0.928   5.952
  550   1HA   GLY  76          HA2       GLY  76   4.185  -1.480   8.664
  551   2HA   GLY  76          HA1       GLY  76   2.926  -2.419   7.881
  552    H    TRP  77           HN       TRP  77   5.796  -2.813   8.935
  553    HA   TRP  77           HA       TRP  77   6.786  -4.325   6.609
  554   1HB   TRP  77          HB2       TRP  77   8.354  -2.605   7.311
  555   2HB   TRP  77          HB1       TRP  77   8.275  -3.161   8.975
  556    HD1  TRP  77           HD1      TRP  77   9.912  -5.075   9.677
  557    HE1  TRP  77           HE1      TRP  77  11.775  -6.368   8.457
  558    HE3  TRP  77           HE3      TRP  77   8.934  -3.582   4.887
  559    HZ2  TRP  77           HZ2      TRP  77  12.701  -6.711   5.818
  560    HZ3  TRP  77           HZ3      TRP  77  10.357  -4.438   3.073
  561    HH2  TRP  77           HH2      TRP  77  12.201  -5.970   3.530
  562    H    CYS  78           HN       CYS  78   6.828  -6.491   6.788
  563    HA   CYS  78           HA       CYS  78   6.323  -7.636   9.462
  564   1HB   CYS  78          HB2       CYS  78   4.619  -7.973   7.542
  565   2HB   CYS  78          HB1       CYS  78   5.809  -9.073   6.865
  566    H    TYR  79           HN       TYR  79   8.172  -8.353  10.307
  567    HA   TYR  79           HA       TYR  79  10.568  -8.592   8.967
  568   1HB   TYR  79          HB2       TYR  79   9.613  -9.623  11.601
  569   2HB   TYR  79          HB1       TYR  79  11.216 -10.063  11.019
  570    HD1  TYR  79           HD1      TYR  79  12.793  -8.167  10.366
  571    HD2  TYR  79           HD2      TYR  79   9.273  -7.557  12.677
  572    HE1  TYR  79           HE1      TYR  79  13.701  -6.033  11.168
  573    HE2  TYR  79           HE2      TYR  79  10.175  -5.414  13.485
  574    HH   TYR  79           HH       TYR  79  12.945  -3.949  12.081
  575    H    VAL  80           HN       VAL  80   8.524 -11.367   9.981
  576    HA   VAL  80           HA       VAL  80  10.264 -13.308   8.927
  577    HB   VAL  80           HB       VAL  80   8.259 -14.844   8.968
  578   1HG1  VAL  80          HG11      VAL  80   8.104 -14.830  11.434
  579   2HG1  VAL  80          HG12      VAL  80   8.938 -13.277  11.451
  580   3HG1  VAL  80          HG13      VAL  80   9.762 -14.714  10.848
  581   1HG2  VAL  80          HG21      VAL  80   6.912 -12.396  10.104
  582   2HG2  VAL  80          HG22      VAL  80   6.245 -14.029  10.099
  583   3HG2  VAL  80          HG23      VAL  80   6.520 -13.184   8.575
  584    H    ASP  81           HN       ASP  81   7.916 -11.323   7.367
  585    HA   ASP  81           HA       ASP  81   7.818 -13.029   5.002
  586   1HB   ASP  81          HB2       ASP  81   6.384 -10.460   5.695
  587   2HB   ASP  81          HB1       ASP  81   6.209 -11.295   4.156
  588    H    GLU  82           HN       GLU  82   9.049  -9.952   6.094
  589    HA   GLU  82           HA       GLU  82  10.508  -8.460   5.248
  590   1HB   GLU  82          HB2       GLU  82  11.161 -10.751   3.400
  591   2HB   GLU  82          HB1       GLU  82  12.019  -9.215   3.363
  592   1HG   GLU  82          HG2       GLU  82  12.757  -9.511   5.628
  593   2HG   GLU  82          HG1       GLU  82  11.786 -10.972   5.792
  594    H    VAL  83           HN       VAL  83   7.749  -8.784   4.299
  595    HA   VAL  83           HA       VAL  83   7.932  -7.385   1.729
  596    HB   VAL  83           HB       VAL  83   5.514  -7.734   1.519
  597   1HG1  VAL  83          HG11      VAL  83   5.528 -10.158   1.206
  598   2HG1  VAL  83          HG12      VAL  83   7.008 -10.270   2.158
  599   3HG1  VAL  83          HG13      VAL  83   7.015  -9.418   0.614
  600   1HG2  VAL  83          HG21      VAL  83   4.885  -7.693   3.865
  601   2HG2  VAL  83          HG22      VAL  83   5.739  -9.211   4.140
  602   3HG2  VAL  83          HG23      VAL  83   4.312  -9.178   3.104
  603    H    MET  84           HN       MET  84   6.855  -5.403   1.446
  604    HA   MET  84           HA       MET  84   6.228  -3.987   3.960
  605   1HB   MET  84          HB2       MET  84   8.375  -3.242   2.960
  606   2HB   MET  84          HB1       MET  84   7.522  -2.828   1.481
  607   1HG   MET  84          HG2       MET  84   6.186  -1.188   2.738
  608   2HG   MET  84          HG1       MET  84   7.113  -1.576   4.187
  609   1HE   MET  84          HE1       MET  84   9.728  -1.102   4.436
  610   2HE   MET  84          HE2       MET  84  10.715  -0.403   3.152
  611   3HE   MET  84          HE3       MET  84  10.024  -2.013   2.956
  612    H    PHE  85           HN       PHE  85   4.229  -3.204   4.049
  613    HA   PHE  85           HA       PHE  85   2.822  -2.698   1.517
  614   1HB   PHE  85          HB2       PHE  85   0.734  -3.562   2.643
  615   2HB   PHE  85          HB1       PHE  85   1.940  -4.785   2.267
  616    HD1  PHE  85           HD1      PHE  85   0.131  -3.054   4.895
  617    HD2  PHE  85           HD2      PHE  85   3.256  -5.821   4.063
  618    HE1  PHE  85           HE1      PHE  85   0.083  -3.811   7.235
  619    HE2  PHE  85           HE2      PHE  85   3.212  -6.576   6.402
  620    HZ   PHE  85           HZ       PHE  85   1.631  -5.568   7.994
  621    H    ASP  86           HN       ASP  86   1.238  -1.078   1.569
  622    HA   ASP  86           HA       ASP  86   1.959   1.081   3.306
  623   1HB   ASP  86          HB2       ASP  86  -0.208   0.867   1.209
  624   2HB   ASP  86          HB1       ASP  86   0.221   2.350   2.057
  625    H    LEU  87           HN       LEU  87   0.991   1.799   5.064
  626    HA   LEU  87           HA       LEU  87  -1.625   0.669   5.793
  627   1HB   LEU  87          HB2       LEU  87   0.868   0.926   7.434
  628   2HB   LEU  87          HB1       LEU  87  -0.702   0.981   8.212
  629    HG   LEU  87           HG       LEU  87   0.332  -1.318   6.547
  630   1HD1  LEU  87          HD11      LEU  87   1.523  -1.098   8.668
  631   2HD1  LEU  87          HD12      LEU  87   0.461  -2.506   8.681
  632   3HD1  LEU  87          HD13      LEU  87  -0.014  -1.036   9.531
  633   1HD2  LEU  87          HD21      LEU  87  -2.152  -1.077   8.238
  634   2HD2  LEU  87          HD22      LEU  87  -1.632  -2.500   7.333
  635   3HD2  LEU  87          HD23      LEU  87  -2.114  -1.036   6.475
  636    H    SER  88           HN       SER  88  -0.772   3.251   4.545
  637    HA   SER  88           HA       SER  88  -0.791   5.338   6.419
  638   1HB   SER  88          HB2       SER  88  -1.791   5.404   3.563
  639   2HB   SER  88          HB1       SER  88  -1.279   6.791   4.525
  640    HG   SER  88           HG       SER  88   0.721   5.108   4.620
  641    H    ASP  89           HN       ASP  89  -3.322   3.410   5.104
  642    HA   ASP  89           HA       ASP  89  -5.480   5.184   5.805
  643   1HB   ASP  89          HB2       ASP  89  -6.894   3.241   5.135
  644   2HB   ASP  89          HB1       ASP  89  -5.751   3.743   3.896
  645    H    ARG  90           HN       ARG  90  -3.652   2.760   7.385
  646    HA   ARG  90           HA       ARG  90  -5.599   2.703   9.606
  647   1HB   ARG  90          HB2       ARG  90  -3.745   0.455   8.791
  648   2HB   ARG  90          HB1       ARG  90  -4.924   0.414  10.092
  649   1HG   ARG  90          HG2       ARG  90  -6.732   0.606   8.472
  650   2HG   ARG  90          HG1       ARG  90  -5.552   0.672   7.161
  651   1HD   ARG  90          HD2       ARG  90  -4.713  -1.564   7.944
  652   2HD   ARG  90          HD1       ARG  90  -6.101  -1.625   9.029
  653    HE   ARG  90           HE       ARG  90  -6.759  -1.145   6.260
  654   1HH1  ARG  90          HH11      ARG  90  -6.276  -3.558   8.749
  655   2HH1  ARG  90          HH12      ARG  90  -7.171  -4.791   7.920
  656   1HH2  ARG  90          HH21      ARG  90  -7.918  -2.755   5.147
  657   2HH2  ARG  90          HH22      ARG  90  -8.101  -4.335   5.853
  658    H    MET  91           HN       MET  91  -3.082   4.310   8.969
  659    HA   MET  91           HA       MET  91  -0.960   3.268  10.523
  660   1HB   MET  91          HB2       MET  91   0.174   5.368  10.137
  661   2HB   MET  91          HB1       MET  91  -0.596   4.827   8.654
  662   1HG   MET  91          HG2       MET  91  -2.395   6.416   8.978
  663   2HG   MET  91          HG1       MET  91  -1.690   6.924  10.514
  664   1HE   MET  91          HE1       MET  91   1.718   8.476   9.306
  665   2HE   MET  91          HE2       MET  91   1.393   6.819   9.816
  666   3HE   MET  91          HE3       MET  91   0.689   8.172  10.704
  667    H    THR  92           HN       THR  92  -0.019   4.081  12.425
  668    HA   THR  92           HA       THR  92  -2.009   5.223  14.278
  669    HB   THR  92           HB       THR  92   0.468   3.640  14.991
  670    HG1  THR  92           HG1      THR  92  -1.592   2.684  13.825
  671   1HG2  THR  92          HG21      THR  92  -0.337   5.098  16.780
  672   2HG2  THR  92          HG22      THR  92  -0.637   3.405  17.175
  673   3HG2  THR  92          HG23      THR  92  -1.960   4.427  16.612
  674    HA   PRO  93           HA       PRO  93   0.782   8.794  13.996
  675   1HB   PRO  93          HB2       PRO  93  -1.345  10.038  15.609
  676   2HB   PRO  93          HB1       PRO  93  -0.696  10.527  14.042
  677   1HG   PRO  93          HG2       PRO  93  -3.153   9.470  14.286
  678   2HG   PRO  93          HG1       PRO  93  -2.134   9.160  12.867
  679   1HD   PRO  93          HD2       PRO  93  -2.670   7.410  15.237
  680   2HD   PRO  93          HD1       PRO  93  -2.558   6.977  13.518
  681    H    HIS  94           HN       HIS  94   2.120   9.788  15.489
  682    HA   HIS  94           HA       HIS  94   2.643   8.416  17.876
  683   1HB   HIS  94          HB2       HIS  94   4.207  10.267  18.403
  684   2HB   HIS  94          HB1       HIS  94   4.418   9.620  16.783
  685    HD1  HIS  94           HD1      HIS  94   3.694  11.167  14.788
  686    HD2  HIS  94           HD2      HIS  94   3.534  12.944  18.548
  687    HE1  HIS  94           HE1      HIS  94   3.576  13.647  14.368
  688    HE2  HIS  94           HE2      HIS  94   3.628  14.704  16.658
  689    H    ASN  95           HN       ASN  95   2.087   8.693  19.944
  690    HA   ASN  95           HA       ASN  95  -0.412   9.974  20.388
  691   1HB   ASN  95          HB2       ASN  95  -0.293   9.043  22.628
  692   2HB   ASN  95          HB1       ASN  95   0.198   7.835  21.450
  693   1HD2  ASN  95          HD21      ASN  95   0.753   7.857  24.242
  694   2HD2  ASN  95          HD22      ASN  95   2.477   7.896  24.422
  695    H    GLY  96           HN       GLY  96   2.905  10.773  21.258
  696   1HA   GLY  96          HA2       GLY  96   1.949  13.403  22.117
  697   2HA   GLY  96          HA1       GLY  96   2.886  12.458  23.262
  698    HA   PRO  97           HA       PRO  97   5.768  15.201  20.913
  699   1HB   PRO  97          HB2       PRO  97   7.136  15.351  23.503
  700   2HB   PRO  97          HB1       PRO  97   6.521  16.655  22.485
  701   1HG   PRO  97          HG2       PRO  97   5.358  16.001  24.821
  702   2HG   PRO  97          HG1       PRO  97   4.423  16.585  23.431
  703   1HD   PRO  97          HD2       PRO  97   4.789  13.783  24.426
  704   2HD   PRO  97          HD1       PRO  97   3.320  14.582  23.825
  705    H    ILE  98           HN       ILE  98   6.971  13.859  19.692
  706    HA   ILE  98           HA       ILE  98   8.962  12.185  21.063
  707    HB   ILE  98           HB       ILE  98   8.067  12.035  18.176
  708   1HG1  ILE  98          HG12      ILE  98   7.457  10.257  20.548
  709   2HG1  ILE  98          HG11      ILE  98   6.308  11.258  19.667
  710   1HG2  ILE  98          HG21      ILE  98   9.387   9.973  18.103
  711   2HG2  ILE  98          HG22      ILE  98   9.913  10.251  19.763
  712   3HG2  ILE  98          HG23      ILE  98  10.394  11.370  18.486
  713   1HD1  ILE  98          HD11      ILE  98   7.789   8.884  18.561
  714   2HD1  ILE  98          HD12      ILE  98   6.627   9.879  17.682
  715   3HD1  ILE  98          HD13      ILE  98   6.099   8.917  19.063
  716    HA   PRO  99           HA       PRO  99  11.701  15.531  19.838
  717   1HB   PRO  99          HB2       PRO  99  13.715  13.808  21.129
  718   2HB   PRO  99          HB1       PRO  99  13.261  15.474  21.499
  719   1HG   PRO  99          HG2       PRO  99  12.599  13.442  23.121
  720   2HG   PRO  99          HG1       PRO  99  11.525  14.834  22.881
  721   1HD   PRO  99          HD2       PRO  99  11.370  12.091  21.685
  722   2HD   PRO  99          HD1       PRO  99  10.066  13.125  22.306
  723    H    ARG 100           HN       ARG 100  12.070  15.423  17.697
  724    HA   ARG 100           HA       ARG 100  13.148  13.096  16.418
  725   1HB   ARG 100          HB2       ARG 100  11.623  14.729  15.278
  726   2HB   ARG 100          HB1       ARG 100  12.932  15.904  15.307
  727   1HG   ARG 100          HG2       ARG 100  13.201  15.063  13.209
  728   2HG   ARG 100          HG1       ARG 100  14.251  13.969  14.109
  729   1HD   ARG 100          HD2       ARG 100  13.062  12.407  12.972
  730   2HD   ARG 100          HD1       ARG 100  11.953  12.621  14.327
  731    HE   ARG 100           HE       ARG 100  11.589  14.236  11.901
  732   1HH1  ARG 100          HH11      ARG 100  10.416  11.739  14.076
  733   2HH1  ARG 100          HH12      ARG 100   8.852  11.659  13.327
  734   1HH2  ARG 100          HH21      ARG 100   9.543  14.116  10.911
  735   2HH2  ARG 100          HH22      ARG 100   8.355  13.019  11.535
  736    H    TYR 101           HN       TYR 101  15.200  12.532  16.791
  737    HA   TYR 101           HA       TYR 101  17.187  14.507  17.459
  738   1HB   TYR 101          HB2       TYR 101  17.372  11.513  17.094
  739   2HB   TYR 101          HB1       TYR 101  18.726  12.531  17.578
  740    HD1  TYR 101           HD1      TYR 101  18.640  13.730  19.761
  741    HD2  TYR 101           HD2      TYR 101  15.707  10.852  18.662
  742    HE1  TYR 101           HE1      TYR 101  17.951  13.543  22.112
  743    HE2  TYR 101           HE2      TYR 101  15.010  10.656  21.012
  744    HH   TYR 101           HH       TYR 101  15.878  11.059  23.233
  745    H    VAL 102           HN       VAL 102  16.314  12.561  14.689
  746    HA   VAL 102           HA       VAL 102  18.351  13.999  13.144
  747    HB   VAL 102           HB       VAL 102  18.217  11.997  11.536
  748   1HG1  VAL 102          HG11      VAL 102  19.950  10.802  12.751
  749   2HG1  VAL 102          HG12      VAL 102  19.471  11.595  14.251
  750   3HG1  VAL 102          HG13      VAL 102  20.166  12.543  12.936
  751   1HG2  VAL 102          HG21      VAL 102  16.256  10.923  12.532
  752   2HG2  VAL 102          HG22      VAL 102  17.146  10.683  14.035
  753   3HG2  VAL 102          HG23      VAL 102  17.655   9.852  12.566
  Start of MODEL   11
    1   1H    MET   1          HT1       MET   1   5.280   1.094  -0.787
    2   2H    MET   1          HT2       MET   1   4.342   0.835  -2.180
    3   3H    MET   1          HT3       MET   1   5.588  -0.241  -1.784
    4    HA   MET   1           HA       MET   1   4.471  -0.997   0.135
    5   1HB   MET   1          HB2       MET   1   2.281  -0.187   0.785
    6   2HB   MET   1          HB1       MET   1   3.420   1.148   0.747
    7   1HG   MET   1          HG2       MET   1   1.452   0.524  -1.442
    8   2HG   MET   1          HG1       MET   1   1.182   1.694  -0.153
    9   1HE   MET   1          HE1       MET   1   1.727   4.086  -3.153
   10   2HE   MET   1          HE2       MET   1   0.719   3.688  -1.762
   11   3HE   MET   1          HE3       MET   1   0.829   2.568  -3.119
   12    H    THR   2           HN       THR   2   2.994  -2.694   0.071
   13    HA   THR   2           HA       THR   2   1.747  -3.223  -2.545
   14    HB   THR   2           HB       THR   2   3.790  -4.602  -2.248
   15    HG1  THR   2           HG1      THR   2   2.517  -5.816  -3.445
   16   1HG2  THR   2          HG21      THR   2   2.342  -5.757   0.137
   17   2HG2  THR   2          HG22      THR   2   3.794  -4.757   0.191
   18   3HG2  THR   2          HG23      THR   2   3.853  -6.360  -0.544
   19    H    MET   3           HN       MET   3   0.366  -5.537  -1.868
   20    HA   MET   3           HA       MET   3  -1.828  -4.520  -0.382
   21   1HB   MET   3          HB2       MET   3  -2.111  -6.224  -2.130
   22   2HB   MET   3          HB1       MET   3  -1.200  -7.375  -1.161
   23   1HG   MET   3          HG2       MET   3  -2.947  -7.155   0.606
   24   2HG   MET   3          HG1       MET   3  -3.885  -6.180  -0.524
   25   1HE   MET   3          HE1       MET   3  -5.064  -8.764   0.866
   26   2HE   MET   3          HE2       MET   3  -5.866  -9.544  -0.498
   27   3HE   MET   3          HE3       MET   3  -5.959  -7.794  -0.304
   28    H    GLY   4           HN       GLY   4   0.677  -6.922   0.358
   29   1HA   GLY   4          HA2       GLY   4   1.633  -6.580   2.660
   30   2HA   GLY   4          HA1       GLY   4  -0.037  -6.626   3.211
   31    H    CYS   5           HN       CYS   5  -0.693  -8.493   3.990
   32    HA   CYS   5           HA       CYS   5  -0.285 -10.991   2.775
   33   1HB   CYS   5          HB2       CYS   5   1.217 -12.031   4.446
   34   2HB   CYS   5          HB1       CYS   5   2.025 -10.760   3.536
   35    H    ARG   6           HN       ARG   6  -0.806 -12.806   4.599
   36    HA   ARG   6           HA       ARG   6  -3.416 -12.144   5.451
   37   1HB   ARG   6          HB2       ARG   6  -3.553 -14.353   6.355
   38   2HB   ARG   6          HB1       ARG   6  -2.646 -14.443   4.854
   39   1HG   ARG   6          HG2       ARG   6  -0.562 -14.571   6.101
   40   2HG   ARG   6          HG1       ARG   6  -1.452 -14.434   7.619
   41   1HD   ARG   6          HD2       ARG   6  -2.671 -16.506   7.037
   42   2HD   ARG   6          HD1       ARG   6  -1.667 -16.657   5.597
   43    HE   ARG   6           HE       ARG   6   0.148 -16.510   7.596
   44   1HH1  ARG   6          HH11      ARG   6  -2.691 -18.490   7.074
   45   2HH1  ARG   6          HH12      ARG   6  -2.056 -19.859   7.947
   46   1HH2  ARG   6          HH21      ARG   6   0.988 -18.295   8.761
   47   2HH2  ARG   6          HH22      ARG   6   0.039 -19.750   8.890
   48    H    HIS   7           HN       HIS   7  -0.358 -11.839   7.000
   49    HA   HIS   7           HA       HIS   7  -1.120 -11.902   9.692
   50   1HB   HIS   7          HB2       HIS   7   1.107 -10.420   8.297
   51   2HB   HIS   7          HB1       HIS   7   0.905 -10.411  10.046
   52    HD2  HIS   7           HD2      HIS   7   0.621 -13.357  10.898
   53    HE1  HIS   7           HE1      HIS   7   3.811 -14.237   8.265
   54    HE2  HIS   7           HE2      HIS   7   2.571 -14.977  10.352
   55    H    VAL   8           HN       VAL   8  -1.608  -9.455   7.273
   56    HA   VAL   8           HA       VAL   8  -2.039  -7.227   8.967
   57    HB   VAL   8           HB       VAL   8  -3.430  -7.693   6.334
   58   1HG1  VAL   8          HG11      VAL   8  -4.219  -5.781   7.628
   59   2HG1  VAL   8          HG12      VAL   8  -3.398  -5.274   6.152
   60   3HG1  VAL   8          HG13      VAL   8  -2.569  -5.159   7.705
   61   1HG2  VAL   8          HG21      VAL   8  -1.533  -6.610   5.260
   62   2HG2  VAL   8          HG22      VAL   8  -1.085  -8.136   6.023
   63   3HG2  VAL   8          HG23      VAL   8  -0.675  -6.607   6.801
   64    H    ALA   9           HN       ALA   9  -3.971  -9.969   8.092
   65    HA   ALA   9           HA       ALA   9  -6.461  -8.765   8.785
   66   1HB   ALA   9          HB1       ALA   9  -5.751 -11.655   8.308
   67   2HB   ALA   9          HB2       ALA   9  -6.397 -10.520   7.122
   68   3HB   ALA   9          HB3       ALA   9  -7.389 -11.028   8.488
   69    H    GLY  10           HN       GLY  10  -3.930  -9.706  10.656
   70   1HA   GLY  10          HA2       GLY  10  -5.703 -10.466  12.893
   71   2HA   GLY  10          HA1       GLY  10  -4.054 -11.050  12.723
   72    H    ILE  11           HN       ILE  11  -4.077  -7.885  11.744
   73    HA   ILE  11           HA       ILE  11  -3.081  -7.032  14.369
   74    HB   ILE  11           HB       ILE  11  -1.952  -5.199  13.220
   75   1HG1  ILE  11          HG12      ILE  11  -2.985  -6.442  10.660
   76   2HG1  ILE  11          HG11      ILE  11  -3.570  -4.936  11.358
   77   1HG2  ILE  11          HG21      ILE  11  -0.276  -6.528  12.038
   78   2HG2  ILE  11          HG22      ILE  11  -1.393  -7.891  11.986
   79   3HG2  ILE  11          HG23      ILE  11  -0.784  -7.308  13.536
   80   1HD1  ILE  11          HD11      ILE  11  -0.776  -5.451  10.369
   81   2HD1  ILE  11          HD12      ILE  11  -1.368  -3.939  11.058
   82   3HD1  ILE  11          HD13      ILE  11  -2.025  -4.531   9.532
   83    H    ARG  12           HN       ARG  12  -3.629  -4.940  15.185
   84    HA   ARG  12           HA       ARG  12  -6.092  -3.790  14.068
   85   1HB   ARG  12          HB2       ARG  12  -7.146  -3.638  16.198
   86   2HB   ARG  12          HB1       ARG  12  -6.584  -5.296  16.048
   87   1HG   ARG  12          HG2       ARG  12  -4.931  -3.230  17.451
   88   2HG   ARG  12          HG1       ARG  12  -6.243  -4.069  18.279
   89   1HD   ARG  12          HD2       ARG  12  -4.041  -5.526  16.838
   90   2HD   ARG  12          HD1       ARG  12  -3.914  -5.050  18.532
   91    HE   ARG  12           HE       ARG  12  -6.216  -6.367  18.575
   92   1HH1  ARG  12          HH11      ARG  12  -3.201  -7.210  17.016
   93   2HH1  ARG  12          HH12      ARG  12  -3.422  -8.921  17.207
   94   1HH2  ARG  12          HH21      ARG  12  -6.521  -8.618  18.841
   95   2HH2  ARG  12          HH22      ARG  12  -5.320  -9.719  18.232
   96    H    THR  13           HN       THR  13  -6.524  -1.572  14.965
   97    HA   THR  13           HA       THR  13  -4.200   0.059  15.033
   98    HB   THR  13           HB       THR  13  -6.964   0.797  16.022
   99    HG1  THR  13           HG1      THR  13  -7.514   1.191  13.952
  100   1HG2  THR  13          HG21      THR  13  -6.301   3.071  15.370
  101   2HG2  THR  13          HG22      THR  13  -4.706   2.471  14.914
  102   3HG2  THR  13          HG23      THR  13  -5.222   2.410  16.600
  103    H    VAL  14           HN       VAL  14  -2.869   0.439  16.692
  104    HA   VAL  14           HA       VAL  14  -3.725  -0.508  19.339
  105    HB   VAL  14           HB       VAL  14  -1.275  -0.689  19.834
  106   1HG1  VAL  14          HG11      VAL  14  -2.631  -2.627  19.204
  107   2HG1  VAL  14          HG12      VAL  14  -0.979  -2.771  18.604
  108   3HG1  VAL  14          HG13      VAL  14  -2.282  -2.318  17.503
  109   1HG2  VAL  14          HG21      VAL  14   0.273  -0.746  17.921
  110   2HG2  VAL  14          HG22      VAL  14  -0.430   0.855  18.158
  111   3HG2  VAL  14          HG23      VAL  14  -1.027  -0.189  16.867
  112    H    THR  15           HN       THR  15  -2.209   0.525  21.090
  113    HA   THR  15           HA       THR  15  -2.083   3.434  20.676
  114    HB   THR  15           HB       THR  15  -2.858   2.056  23.260
  115    HG1  THR  15           HG1      THR  15  -4.360   2.267  21.179
  116   1HG2  THR  15          HG21      THR  15  -3.506   4.309  23.976
  117   2HG2  THR  15          HG22      THR  15  -2.949   4.963  22.436
  118   3HG2  THR  15          HG23      THR  15  -1.794   4.242  23.557
  119    HA   PRO  16           HA       PRO  16   2.188   2.641  21.713
  120   1HB   PRO  16          HB2       PRO  16   2.289   5.555  22.187
  121   2HB   PRO  16          HB1       PRO  16   3.221   4.567  21.059
  122   1HG   PRO  16          HG2       PRO  16   1.292   6.206  20.196
  123   2HG   PRO  16          HG1       PRO  16   1.575   4.629  19.434
  124   1HD   PRO  16          HD2       PRO  16  -0.544   5.438  21.389
  125   2HD   PRO  16          HD1       PRO  16  -0.673   4.404  19.949
  126    H    SER  17           HN       SER  17   3.013   2.014  23.600
  127    HA   SER  17           HA       SER  17   1.799   2.754  26.081
  128   1HB   SER  17          HB2       SER  17   3.502   1.252  27.076
  129   2HB   SER  17          HB1       SER  17   2.657   0.490  25.729
  130    HG   SER  17           HG       SER  17   5.308   1.114  26.016
  131    H    ALA  18           HN       ALA  18   4.170   4.178  24.178
  132    HA   ALA  18           HA       ALA  18   5.078   5.841  26.405
  133   1HB   ALA  18          HB1       ALA  18   6.772   4.099  26.165
  134   2HB   ALA  18          HB2       ALA  18   7.412   5.666  25.668
  135   3HB   ALA  18          HB3       ALA  18   6.935   4.482  24.452
  136    H    LEU  19           HN       LEU  19   6.759   7.515  25.228
  137    HA   LEU  19           HA       LEU  19   5.212   8.717  23.047
  138   1HB   LEU  19          HB2       LEU  19   7.546   9.838  24.609
  139   2HB   LEU  19          HB1       LEU  19   6.585  10.712  23.432
  140    HG   LEU  19           HG       LEU  19   5.622   9.679  26.102
  141   1HD1  LEU  19          HD11      LEU  19   7.087  11.613  26.284
  142   2HD1  LEU  19          HD12      LEU  19   5.421  12.048  26.666
  143   3HD1  LEU  19          HD13      LEU  19   6.109  12.481  25.101
  144   1HD2  LEU  19          HD21      LEU  19   4.160  11.243  23.977
  145   2HD2  LEU  19          HD22      LEU  19   3.545  10.871  25.587
  146   3HD2  LEU  19          HD23      LEU  19   3.850   9.570  24.436
  147    H    GLY  20           HN       GLY  20   8.461   7.669  23.908
  148   1HA   GLY  20          HA2       GLY  20   9.007   7.235  21.049
  149   2HA   GLY  20          HA1       GLY  20  10.198   8.032  22.069
  150    H    CYS  21           HN       CYS  21  11.806   6.685  22.546
  151    HA   CYS  21           HA       CYS  21  11.392   3.836  22.592
  152   1HB   CYS  21          HB2       CYS  21  13.807   5.575  23.017
  153   2HB   CYS  21          HB1       CYS  21  13.853   3.832  23.263
  154    HG   CYS  21           HG       CYS  21  13.752   5.593  20.403
  155    H    GLU  22           HN       GLU  22  10.199   3.219  24.257
  156    HA   GLU  22           HA       GLU  22   9.991   4.208  26.792
  157   1HB   GLU  22          HB2       GLU  22   8.563   2.472  25.738
  158   2HB   GLU  22          HB1       GLU  22   9.842   1.297  25.999
  159   1HG   GLU  22          HG2       GLU  22   9.614   1.512  28.384
  160   2HG   GLU  22          HG1       GLU  22   8.427   2.804  28.185
  161    H    GLU  23           HN       GLU  23  12.030   1.385  25.948
  162    HA   GLU  23           HA       GLU  23  13.238   1.224  28.491
  163   1HB   GLU  23          HB2       GLU  23  13.185  -0.656  26.891
  164   2HB   GLU  23          HB1       GLU  23  14.301   0.217  25.848
  165   1HG   GLU  23          HG2       GLU  23  15.817   0.256  27.966
  166   2HG   GLU  23          HG1       GLU  23  14.802  -1.092  28.480
  167    H    CYS  24           HN       CYS  24  14.411   2.599  25.431
  168    HA   CYS  24           HA       CYS  24  17.011   3.133  26.131
  169   1HB   CYS  24          HB2       CYS  24  15.233   4.733  24.294
  170   2HB   CYS  24          HB1       CYS  24  16.988   4.840  24.350
  171    HG   CYS  24           HG       CYS  24  16.751   3.360  22.169
  172    H    LEU  25           HN       LEU  25  14.157   4.969  27.009
  173    HA   LEU  25           HA       LEU  25  15.287   7.416  27.682
  174   1HB   LEU  25          HB2       LEU  25  13.027   5.937  29.022
  175   2HB   LEU  25          HB1       LEU  25  13.417   7.620  29.315
  176    HG   LEU  25           HG       LEU  25  12.536   6.463  26.671
  177   1HD1  LEU  25          HD11      LEU  25  10.480   7.725  27.070
  178   2HD1  LEU  25          HD12      LEU  25  11.078   8.194  28.662
  179   3HD1  LEU  25          HD13      LEU  25  10.742   6.498  28.310
  180   1HD2  LEU  25          HD21      LEU  25  12.405   8.784  25.935
  181   2HD2  LEU  25          HD22      LEU  25  14.052   8.364  26.406
  182   3HD2  LEU  25          HD23      LEU  25  13.042   9.322  27.489
  183    H    LYS  26           HN       LYS  26  15.442   4.366  29.388
  184    HA   LYS  26           HA       LYS  26  16.063   5.360  31.950
  185   1HB   LYS  26          HB2       LYS  26  16.732   3.131  32.517
  186   2HB   LYS  26          HB1       LYS  26  15.341   3.021  31.450
  187   1HG   LYS  26          HG2       LYS  26  16.987   2.657  29.563
  188   2HG   LYS  26          HG1       LYS  26  18.217   2.456  30.809
  189   1HD   LYS  26          HD2       LYS  26  15.697   0.819  30.549
  190   2HD   LYS  26          HD1       LYS  26  17.309   0.303  30.058
  191   1HE   LYS  26          HE2       LYS  26  18.069   0.508  32.385
  192   2HE   LYS  26          HE1       LYS  26  16.443   0.993  32.864
  193   1HZ   LYS  26          HZ1       LYS  26  15.615  -1.151  32.143
  194   2HZ   LYS  26          HZ2       LYS  26  16.855  -1.363  33.282
  195   3HZ   LYS  26          HZ3       LYS  26  17.166  -1.616  31.636
  196    H    ILE  27           HN       ILE  27  18.041   4.918  29.113
  197    HA   ILE  27           HA       ILE  27  20.390   5.770  30.682
  198    HB   ILE  27           HB       ILE  27  21.802   4.574  28.991
  199   1HG1  ILE  27          HG12      ILE  27  19.168   3.285  28.233
  200   2HG1  ILE  27          HG11      ILE  27  20.091   4.392  27.222
  201   1HG2  ILE  27          HG21      ILE  27  19.936   2.903  30.662
  202   2HG2  ILE  27          HG22      ILE  27  21.455   3.628  31.182
  203   3HG2  ILE  27          HG23      ILE  27  21.459   2.342  29.975
  204   1HD1  ILE  27          HD11      ILE  27  21.001   1.677  28.150
  205   2HD1  ILE  27          HD12      ILE  27  21.924   2.784  27.134
  206   3HD1  ILE  27          HD13      ILE  27  20.418   2.087  26.537
  207    H    GLY  28           HN       GLY  28  18.218   6.882  28.590
  208   1HA   GLY  28          HA2       GLY  28  18.175   8.643  27.112
  209   2HA   GLY  28          HA1       GLY  28  19.805   9.028  27.648
  210    H    SER  29           HN       SER  29  18.643   6.079  26.097
  211    HA   SER  29           HA       SER  29  20.837   6.166  24.227
  212   1HB   SER  29          HB2       SER  29  20.088   4.050  25.293
  213   2HB   SER  29          HB1       SER  29  18.546   4.193  24.454
  214    HG   SER  29           HG       SER  29  21.074   4.049  23.153
  215    HA   PRO  30           HA       PRO  30  18.387   8.353  21.206
  216   1HB   PRO  30          HB2       PRO  30  20.274   8.528  19.294
  217   2HB   PRO  30          HB1       PRO  30  20.341   9.493  20.773
  218   1HG   PRO  30          HG2       PRO  30  21.812   6.982  20.080
  219   2HG   PRO  30          HG1       PRO  30  22.408   8.440  20.893
  220   1HD   PRO  30          HD2       PRO  30  21.687   6.153  22.211
  221   2HD   PRO  30          HD1       PRO  30  21.613   7.771  22.936
  222    H    TRP  31           HN       TRP  31  17.879   8.114  18.831
  223    HA   TRP  31           HA       TRP  31  18.145   5.449  17.737
  224   1HB   TRP  31          HB2       TRP  31  15.708   5.128  17.488
  225   2HB   TRP  31          HB1       TRP  31  16.194   5.176  19.177
  226    HD1  TRP  31           HD1      TRP  31  14.200   7.147  16.575
  227    HE1  TRP  31           HE1      TRP  31  12.762   8.902  17.788
  228    HE3  TRP  31           HE3      TRP  31  16.085   6.623  21.302
  229    HZ2  TRP  31           HZ2      TRP  31  12.463   9.925  20.399
  230    HZ3  TRP  31           HZ3      TRP  31  15.165   8.028  23.098
  231    HH2  TRP  31           HH2      TRP  31  13.392   9.645  22.656
  232    H    VAL  32           HN       VAL  32  17.401   5.316  15.526
  233    HA   VAL  32           HA       VAL  32  17.657   7.794  14.078
  234    HB   VAL  32           HB       VAL  32  16.955   5.032  13.048
  235   1HG1  VAL  32          HG11      VAL  32  17.625   5.879  10.862
  236   2HG1  VAL  32          HG12      VAL  32  17.911   7.474  11.558
  237   3HG1  VAL  32          HG13      VAL  32  16.277   6.812  11.514
  238   1HG2  VAL  32          HG21      VAL  32  19.610   6.457  13.193
  239   2HG2  VAL  32          HG22      VAL  32  19.319   4.932  12.356
  240   3HG2  VAL  32          HG23      VAL  32  19.130   5.026  14.107
  241    H    HIS  33           HN       HIS  33  15.136   5.276  14.114
  242    HA   HIS  33           HA       HIS  33  13.085   7.334  14.294
  243   1HB   HIS  33          HB2       HIS  33  13.198   5.284  12.072
  244   2HB   HIS  33          HB1       HIS  33  11.729   6.148  12.509
  245    HD1  HIS  33           HD1      HIS  33  12.002   8.885  12.361
  246    HD2  HIS  33           HD2      HIS  33  14.691   6.552  10.199
  247    HE1  HIS  33           HE1      HIS  33  12.989  10.411  10.616
  248    HE2  HIS  33           HE2      HIS  33  14.721   9.021   9.428
  249    H    LEU  34           HN       LEU  34  10.847   5.868  14.163
  250    HA   LEU  34           HA       LEU  34  11.220   3.729  16.144
  251   1HB   LEU  34          HB2       LEU  34   9.214   5.980  16.265
  252   2HB   LEU  34          HB1       LEU  34   9.216   4.589  17.332
  253    HG   LEU  34           HG       LEU  34  11.461   6.597  17.148
  254   1HD1  LEU  34          HD11      LEU  34  10.641   7.422  19.294
  255   2HD1  LEU  34          HD12      LEU  34   9.270   6.316  19.200
  256   3HD1  LEU  34          HD13      LEU  34   9.432   7.624  18.027
  257   1HD2  LEU  34          HD21      LEU  34  10.902   4.375  19.106
  258   2HD2  LEU  34          HD22      LEU  34  12.228   5.533  19.207
  259   3HD2  LEU  34          HD23      LEU  34  12.164   4.379  17.875
  260    H    ARG  35           HN       ARG  35   9.845   2.024  16.008
  261    HA   ARG  35           HA       ARG  35   7.520   2.254  14.257
  262   1HB   ARG  35          HB2       ARG  35   7.984  -0.075  13.390
  263   2HB   ARG  35          HB1       ARG  35   9.019   1.199  12.771
  264   1HG   ARG  35          HG2       ARG  35  10.169  -0.048  15.112
  265   2HG   ARG  35          HG1       ARG  35   9.814  -1.228  13.847
  266   1HD   ARG  35          HD2       ARG  35  10.912   0.624  12.313
  267   2HD   ARG  35          HD1       ARG  35  11.686   1.087  13.826
  268    HE   ARG  35           HE       ARG  35  12.239  -1.502  13.797
  269   1HH1  ARG  35          HH11      ARG  35  12.399   0.828  11.192
  270   2HH1  ARG  35          HH12      ARG  35  13.672  -0.001  10.346
  271   1HH2  ARG  35          HH21      ARG  35  13.925  -2.616  12.675
  272   2HH2  ARG  35          HH22      ARG  35  14.507  -1.953  11.172
  273    H    ILE  36           HN       ILE  36   5.819   0.833  14.757
  274    HA   ILE  36           HA       ILE  36   5.998  -0.338  17.460
  275    HB   ILE  36           HB       ILE  36   4.993   1.874  17.660
  276   1HG1  ILE  36          HG12      ILE  36   2.896  -0.296  17.899
  277   2HG1  ILE  36          HG11      ILE  36   4.125   0.076  19.105
  278   1HG2  ILE  36          HG21      ILE  36   2.906   2.456  16.537
  279   2HG2  ILE  36          HG22      ILE  36   2.940   0.923  15.667
  280   3HG2  ILE  36          HG23      ILE  36   4.192   2.130  15.373
  281   1HD1  ILE  36          HD11      ILE  36   3.153   2.296  19.405
  282   2HD1  ILE  36          HD12      ILE  36   1.978   1.018  19.721
  283   3HD1  ILE  36          HD13      ILE  36   1.920   1.915  18.203
  284    H    CYS  37           HN       CYS  37   4.863  -2.248  17.747
  285    HA   CYS  37           HA       CYS  37   3.976  -3.676  15.450
  286   1HB   CYS  37          HB2       CYS  37   3.154  -4.279  18.286
  287   2HB   CYS  37          HB1       CYS  37   3.200  -5.390  16.931
  288    H    ARG  38           HN       ARG  38   1.948  -3.960  14.623
  289    HA   ARG  38           HA       ARG  38  -0.257  -2.392  15.646
  290   1HB   ARG  38          HB2       ARG  38  -0.067  -4.429  13.416
  291   2HB   ARG  38          HB1       ARG  38  -1.528  -3.532  13.803
  292   1HG   ARG  38          HG2       ARG  38   1.073  -2.238  13.028
  293   2HG   ARG  38          HG1       ARG  38  -0.217  -2.630  11.888
  294   1HD   ARG  38          HD2       ARG  38  -0.490  -0.830  14.292
  295   2HD   ARG  38          HD1       ARG  38  -0.296  -0.283  12.627
  296    HE   ARG  38           HE       ARG  38  -2.560  -2.027  13.177
  297   1HH1  ARG  38          HH11      ARG  38  -1.372   1.226  12.695
  298   2HH1  ARG  38          HH12      ARG  38  -2.948   1.880  12.351
  299   1HH2  ARG  38          HH21      ARG  38  -4.636  -1.161  12.700
  300   2HH2  ARG  38          HH22      ARG  38  -4.796   0.533  12.373
  301    H    THR  39           HN       THR  39   0.720  -4.111  17.573
  302    HA   THR  39           HA       THR  39  -1.404  -6.089  17.889
  303    HB   THR  39           HB       THR  39   1.385  -6.956  18.531
  304    HG1  THR  39           HG1      THR  39   0.401  -7.655  16.015
  305   1HG2  THR  39          HG21      THR  39  -0.496  -8.333  19.245
  306   2HG2  THR  39          HG22      THR  39   0.447  -9.166  18.008
  307   3HG2  THR  39          HG23      THR  39  -1.087  -8.407  17.584
  308    H    CYS  40           HN       CYS  40   1.665  -5.168  19.509
  309    HA   CYS  40           HA       CYS  40   0.257  -5.442  22.061
  310   1HB   CYS  40          HB2       CYS  40   2.378  -5.800  23.097
  311   2HB   CYS  40          HB1       CYS  40   2.350  -6.766  21.629
  312    H    GLY  41           HN       GLY  41   1.146  -2.988  20.008
  313   1HA   GLY  41          HA2       GLY  41   1.051  -0.707  20.260
  314   2HA   GLY  41          HA1       GLY  41   0.452  -0.985  21.885
  315    H    HIS  42           HN       HIS  42   3.476  -2.448  21.277
  316    HA   HIS  42           HA       HIS  42   4.737  -0.465  22.990
  317   1HB   HIS  42          HB2       HIS  42   5.031  -2.794  23.631
  318   2HB   HIS  42          HB1       HIS  42   5.712  -3.172  22.054
  319    HD1  HIS  42           HD1      HIS  42   6.551  -1.514  25.318
  320    HD2  HIS  42           HD2      HIS  42   8.393  -2.513  21.723
  321    HE1  HIS  42           HE1      HIS  42   9.010  -1.134  25.683
  322    HE2  HIS  42           HE2      HIS  42  10.110  -1.989  23.581
  323    H    VAL  43           HN       VAL  43   6.122   0.994  22.312
  324    HA   VAL  43           HA       VAL  43   6.746   1.174  19.491
  325    HB   VAL  43           HB       VAL  43   7.486   3.029  21.762
  326   1HG1  VAL  43          HG11      VAL  43   7.535   3.460  18.778
  327   2HG1  VAL  43          HG12      VAL  43   8.938   3.316  19.838
  328   3HG1  VAL  43          HG13      VAL  43   7.847   4.693  19.999
  329   1HG2  VAL  43          HG21      VAL  43   5.211   3.239  19.794
  330   2HG2  VAL  43          HG22      VAL  43   5.614   4.402  21.057
  331   3HG2  VAL  43          HG23      VAL  43   5.056   2.786  21.491
  332    H    GLY  44           HN       GLY  44   8.647   0.655  18.576
  333   1HA   GLY  44          HA2       GLY  44  10.966   0.225  20.359
  334   2HA   GLY  44          HA1       GLY  44  10.578  -0.888  19.054
  335    H    CYS  45           HN       CYS  45  13.002   0.715  19.503
  336    HA   CYS  45           HA       CYS  45  12.970   2.784  17.507
  337   1HB   CYS  45          HB2       CYS  45  15.371   2.983  17.985
  338   2HB   CYS  45          HB1       CYS  45  14.426   2.989  19.469
  339    HG   CYS  45           HG       CYS  45  16.620   0.690  18.329
  340    H    CYS  46           HN       CYS  46  14.145   2.767  15.557
  341    HA   CYS  46           HA       CYS  46  14.035   0.442  14.023
  342   1HB   CYS  46          HB2       CYS  46  15.647   2.967  13.649
  343   2HB   CYS  46          HB1       CYS  46  15.528   1.699  12.434
  344    HG   CYS  46           HG       CYS  46  13.717   3.214  11.332
  345    H    ASP  47           HN       ASP  47  15.567  -0.994  13.308
  346    HA   ASP  47           HA       ASP  47  17.654  -1.621  15.187
  347   1HB   ASP  47          HB2       ASP  47  16.888  -2.967  12.593
  348   2HB   ASP  47          HB1       ASP  47  17.957  -3.631  13.830
  349    H    ASP  48           HN       ASP  48  17.459   0.430  12.624
  350    HA   ASP  48           HA       ASP  48  20.053   0.300  11.530
  351   1HB   ASP  48          HB2       ASP  48  18.441   2.815  12.033
  352   2HB   ASP  48          HB1       ASP  48  19.677   2.569  10.804
  353    H    SER  49           HN       SER  49  18.740   1.485  14.508
  354    HA   SER  49           HA       SER  49  21.198   2.745  15.361
  355   1HB   SER  49          HB2       SER  49  18.691   2.131  16.952
  356   2HB   SER  49          HB1       SER  49  19.977   3.254  17.398
  357    HG   SER  49           HG       SER  49  19.340   4.191  15.176
  358    HA   PRO  50           HA       PRO  50  23.341  -0.769  16.881
  359   1HB   PRO  50          HB2       PRO  50  23.683   0.853  19.362
  360   2HB   PRO  50          HB1       PRO  50  24.894   0.002  18.397
  361   1HG   PRO  50          HG2       PRO  50  24.628   2.646  18.232
  362   2HG   PRO  50          HG1       PRO  50  24.986   1.669  16.797
  363   1HD   PRO  50          HD2       PRO  50  22.448   2.993  17.599
  364   2HD   PRO  50          HD1       PRO  50  23.088   2.656  15.980
  365    H    HIS  51           HN       HIS  51  20.998   0.734  19.060
  366    HA   HIS  51           HA       HIS  51  20.888  -1.285  20.998
  367   1HB   HIS  51          HB2       HIS  51  19.689   1.155  20.665
  368   2HB   HIS  51          HB1       HIS  51  18.335   0.058  20.442
  369    HD1  HIS  51           HD1      HIS  51  19.750   1.958  22.995
  370    HD2  HIS  51           HD2      HIS  51  18.525  -2.015  22.764
  371    HE1  HIS  51           HE1      HIS  51  19.271   1.253  25.360
  372    HE2  HIS  51           HE2      HIS  51  18.377  -1.094  25.183
  373    H    LYS  52           HN       LYS  52  19.182  -0.896  17.951
  374    HA   LYS  52           HA       LYS  52  17.582  -2.106  16.874
  375   1HB   LYS  52          HB2       LYS  52  19.281  -4.420  17.794
  376   2HB   LYS  52          HB1       LYS  52  18.204  -4.394  16.410
  377   1HG   LYS  52          HG2       LYS  52  19.640  -2.540  15.480
  378   2HG   LYS  52          HG1       LYS  52  20.796  -2.928  16.758
  379   1HD   LYS  52          HD2       LYS  52  19.755  -4.844  14.682
  380   2HD   LYS  52          HD1       LYS  52  21.339  -4.067  14.657
  381   1HE   LYS  52          HE2       LYS  52  21.978  -5.196  16.692
  382   2HE   LYS  52          HE1       LYS  52  20.361  -5.871  16.869
  383   1HZ   LYS  52          HZ1       LYS  52  20.704  -7.133  14.835
  384   2HZ   LYS  52          HZ2       LYS  52  21.898  -7.500  15.982
  385   3HZ   LYS  52          HZ3       LYS  52  22.267  -6.489  14.671
  386    H    HIS  53           HN       HIS  53  15.965  -1.544  18.523
  387    HA   HIS  53           HA       HIS  53  15.316  -3.556  20.466
  388   1HB   HIS  53          HB2       HIS  53  14.338  -0.872  19.796
  389   2HB   HIS  53          HB1       HIS  53  13.097  -1.978  20.379
  390    HD1  HIS  53           HD1      HIS  53  15.099   0.514  21.702
  391    HD2  HIS  53           HD2      HIS  53  14.422  -3.434  22.809
  392    HE1  HIS  53           HE1      HIS  53  15.698   0.380  24.142
  393    HE2  HIS  53           HE2      HIS  53  15.244  -2.015  24.808
  394    H    ALA  54           HN       ALA  54  14.154  -2.684  17.265
  395    HA   ALA  54           HA       ALA  54  11.648  -3.957  17.501
  396   1HB   ALA  54          HB1       ALA  54  12.124  -2.206  15.854
  397   2HB   ALA  54          HB2       ALA  54  11.439  -3.654  15.117
  398   3HB   ALA  54          HB3       ALA  54  13.167  -3.328  14.980
  399    H    THR  55           HN       THR  55  14.712  -5.088  16.029
  400    HA   THR  55           HA       THR  55  13.637  -7.574  15.195
  401    HB   THR  55           HB       THR  55  16.052  -8.325  15.104
  402    HG1  THR  55           HG1      THR  55  16.570  -5.580  15.722
  403   1HG2  THR  55          HG21      THR  55  14.903  -7.378  13.165
  404   2HG2  THR  55          HG22      THR  55  16.600  -6.896  13.203
  405   3HG2  THR  55          HG23      THR  55  15.349  -5.755  13.694
  406    H    ARG  56           HN       ARG  56  15.453  -6.644  18.107
  407    HA   ARG  56           HA       ARG  56  15.569  -9.265  19.174
  408   1HB   ARG  56          HB2       ARG  56  15.746  -6.609  20.607
  409   2HB   ARG  56          HB1       ARG  56  16.181  -8.168  21.297
  410   1HG   ARG  56          HG2       ARG  56  17.888  -8.413  19.502
  411   2HG   ARG  56          HG1       ARG  56  17.514  -6.765  18.993
  412   1HD   ARG  56          HD2       ARG  56  19.442  -6.689  20.401
  413   2HD   ARG  56          HD1       ARG  56  18.087  -5.999  21.291
  414    HE   ARG  56           HE       ARG  56  18.009  -8.522  22.144
  415   1HH1  ARG  56          HH11      ARG  56  20.732  -6.335  21.758
  416   2HH1  ARG  56          HH12      ARG  56  21.651  -7.069  23.044
  417   1HH2  ARG  56          HH21      ARG  56  19.243  -9.484  23.826
  418   2HH2  ARG  56          HH22      ARG  56  20.806  -8.831  24.213
  419    H    HIS  57           HN       HIS  57  13.270  -6.617  19.534
  420    HA   HIS  57           HA       HIS  57  11.630  -7.880  21.465
  421   1HB   HIS  57          HB2       HIS  57  11.435  -5.505  21.104
  422   2HB   HIS  57          HB1       HIS  57  11.036  -5.742  19.408
  423    HD1  HIS  57           HD1      HIS  57   9.501  -5.724  22.826
  424    HD2  HIS  57           HD2      HIS  57   8.426  -6.562  18.894
  425    HE1  HIS  57           HE1      HIS  57   6.974  -5.839  22.780
  426    H    PHE  58           HN       PHE  58  11.621  -7.855  17.922
  427    HA   PHE  58           HA       PHE  58   9.335  -9.441  17.535
  428   1HB   PHE  58          HB2       PHE  58  10.232  -8.306  15.646
  429   2HB   PHE  58          HB1       PHE  58  11.819  -9.029  15.872
  430    HD1  PHE  58           HD1      PHE  58   8.340 -10.375  15.564
  431    HD2  PHE  58           HD2      PHE  58  12.356 -10.454  14.183
  432    HE1  PHE  58           HE1      PHE  58   7.756 -12.164  13.981
  433    HE2  PHE  58           HE2      PHE  58  11.784 -12.243  12.597
  434    HZ   PHE  58           HZ       PHE  58   9.479 -13.104  12.496
  435    H    HIS  59           HN       HIS  59  12.728 -10.304  18.052
  436    HA   HIS  59           HA       HIS  59  12.433 -13.079  17.652
  437   1HB   HIS  59          HB2       HIS  59  14.610 -11.855  17.693
  438   2HB   HIS  59          HB1       HIS  59  14.440 -11.686  19.436
  439    HD1  HIS  59           HD1      HIS  59  15.062 -13.691  20.883
  440    HD2  HIS  59           HD2      HIS  59  15.118 -14.506  16.800
  441    HE1  HIS  59           HE1      HIS  59  16.157 -15.944  20.651
  442    HE2  HIS  59           HE2      HIS  59  16.339 -16.332  18.164
  443    H    ALA  60           HN       ALA  60  11.833 -11.029  20.414
  444    HA   ALA  60           HA       ALA  60  11.682 -13.263  22.247
  445   1HB   ALA  60          HB1       ALA  60  11.230 -11.575  23.946
  446   2HB   ALA  60          HB2       ALA  60  11.113 -10.338  22.694
  447   3HB   ALA  60          HB3       ALA  60  12.649 -11.154  22.987
  448    H    THR  61           HN       THR  61   9.413 -10.980  20.735
  449    HA   THR  61           HA       THR  61   7.220 -12.256  22.202
  450    HB   THR  61           HB       THR  61   5.846 -10.336  21.435
  451    HG1  THR  61           HG1      THR  61   8.330  -9.336  20.435
  452   1HG2  THR  61          HG21      THR  61   6.990 -10.253  23.598
  453   2HG2  THR  61          HG22      THR  61   6.923  -8.654  22.855
  454   3HG2  THR  61          HG23      THR  61   8.422  -9.582  22.819
  455    H    GLY  62           HN       GLY  62   8.469 -11.907  18.972
  456   1HA   GLY  62          HA2       GLY  62   7.851 -13.064  17.062
  457   2HA   GLY  62          HA1       GLY  62   6.533 -13.793  17.969
  458    H    HIS  63           HN       HIS  63   7.255 -10.363  17.426
  459    HA   HIS  63           HA       HIS  63   4.619 -10.117  16.131
  460   1HB   HIS  63          HB2       HIS  63   6.199  -8.066  17.701
  461   2HB   HIS  63          HB1       HIS  63   4.725  -7.702  16.809
  462    HD2  HIS  63           HD2      HIS  63   3.391 -10.676  17.978
  463    HE1  HIS  63           HE1      HIS  63   3.444  -8.415  21.549
  464    HE2  HIS  63           HE2      HIS  63   2.325 -10.328  20.315
  465    HA   PRO  64           HA       PRO  64   7.607  -9.470  12.820
  466   1HB   PRO  64          HB2       PRO  64   6.074 -10.331  10.797
  467   2HB   PRO  64          HB1       PRO  64   6.791 -11.448  11.964
  468   1HG   PRO  64          HG2       PRO  64   3.998 -10.380  11.834
  469   2HG   PRO  64          HG1       PRO  64   4.549 -12.032  12.170
  470   1HD   PRO  64          HD2       PRO  64   3.805 -10.243  14.109
  471   2HD   PRO  64          HD1       PRO  64   4.941 -11.578  14.381
  472    H    ILE  65           HN       ILE  65   4.502  -7.949  13.182
  473    HA   ILE  65           HA       ILE  65   5.046  -6.254  10.851
  474    HB   ILE  65           HB       ILE  65   2.464  -6.716  12.339
  475   1HG1  ILE  65          HG12      ILE  65   3.358  -7.289   9.504
  476   2HG1  ILE  65          HG11      ILE  65   3.100  -8.484  10.770
  477   1HG2  ILE  65          HG21      ILE  65   3.046  -4.787  10.088
  478   2HG2  ILE  65          HG22      ILE  65   2.579  -4.369  11.737
  479   3HG2  ILE  65          HG23      ILE  65   1.436  -5.197  10.680
  480   1HD1  ILE  65          HD11      ILE  65   1.252  -8.452   9.206
  481   2HD1  ILE  65          HD12      ILE  65   0.994  -6.735   9.519
  482   3HD1  ILE  65          HD13      ILE  65   0.720  -7.915  10.801
  483    H    ILE  66           HN       ILE  66   5.855  -4.380  11.125
  484    HA   ILE  66           HA       ILE  66   5.324  -2.881  13.605
  485    HB   ILE  66           HB       ILE  66   7.534  -1.764  13.221
  486   1HG1  ILE  66          HG12      ILE  66   7.988  -4.057  11.295
  487   2HG1  ILE  66          HG11      ILE  66   7.723  -2.385  10.813
  488   1HG2  ILE  66          HG21      ILE  66   7.257  -3.521  14.891
  489   2HG2  ILE  66          HG22      ILE  66   8.861  -3.585  14.160
  490   3HG2  ILE  66          HG23      ILE  66   7.623  -4.743  13.673
  491   1HD1  ILE  66          HD11      ILE  66  10.072  -2.945  10.743
  492   2HD1  ILE  66          HD12      ILE  66  10.030  -3.418  12.441
  493   3HD1  ILE  66          HD13      ILE  66   9.763  -1.735  11.988
  494    H    GLU  67           HN       GLU  67   4.499  -0.903  13.352
  495    HA   GLU  67           HA       GLU  67   4.081   0.056  10.617
  496   1HB   GLU  67          HB2       GLU  67   2.062  -0.278  11.898
  497   2HB   GLU  67          HB1       GLU  67   2.693   0.685  13.225
  498   1HG   GLU  67          HG2       GLU  67   2.531   2.685  11.958
  499   2HG   GLU  67          HG1       GLU  67   2.173   1.790  10.481
  500    H    GLY  68           HN       GLY  68   4.579   2.150  10.010
  501   1HA   GLY  68          HA2       GLY  68   6.812   3.396  11.226
  502   2HA   GLY  68          HA1       GLY  68   5.803   4.096   9.967
  503    H    TYR  69           HN       TYR  69   6.615   4.108  13.256
  504    HA   TYR  69           HA       TYR  69   4.192   5.462  14.116
  505   1HB   TYR  69          HB2       TYR  69   4.996   3.777  15.598
  506   2HB   TYR  69          HB1       TYR  69   6.631   4.423  15.555
  507    HD1  TYR  69           HD1      TYR  69   3.178   5.515  16.507
  508    HD2  TYR  69           HD2      TYR  69   7.343   5.637  17.355
  509    HE1  TYR  69           HE1      TYR  69   2.723   6.815  18.544
  510    HE2  TYR  69           HE2      TYR  69   6.900   6.938  19.389
  511    HH   TYR  69           HH       TYR  69   5.350   8.145  20.491
  512    H    ASP  70           HN       ASP  70   7.693   6.093  14.332
  513    HA   ASP  70           HA       ASP  70   7.319   8.839  15.001
  514   1HB   ASP  70          HB2       ASP  70   9.296   7.922  15.847
  515   2HB   ASP  70          HB1       ASP  70   9.714   7.175  14.312
  516    HA   PRO  71           HA       PRO  71   8.448   9.695  10.387
  517   1HB   PRO  71          HB2       PRO  71   8.017   7.162   8.984
  518   2HB   PRO  71          HB1       PRO  71   9.404   8.252   8.914
  519   1HG   PRO  71          HG2       PRO  71   9.533   5.826  10.089
  520   2HG   PRO  71          HG1       PRO  71  10.478   7.214  10.661
  521   1HD   PRO  71          HD2       PRO  71   7.935   6.070  11.760
  522   2HD   PRO  71          HD1       PRO  71   9.372   6.659  12.624
  523    HA   PRO  72           HA       PRO  72   3.947   9.701  10.256
  524   1HB   PRO  72          HB2       PRO  72   4.197  12.283   8.942
  525   2HB   PRO  72          HB1       PRO  72   3.557  11.910  10.544
  526   1HG   PRO  72          HG2       PRO  72   5.887  13.251  10.158
  527   2HG   PRO  72          HG1       PRO  72   5.585  12.221  11.569
  528   1HD   PRO  72          HD2       PRO  72   7.130  11.610   9.074
  529   2HD   PRO  72          HD1       PRO  72   7.522  11.223  10.764
  530    H    GLU  73           HN       GLU  73   4.292   7.993   8.582
  531    HA   GLU  73           HA       GLU  73   3.590   9.054   5.923
  532   1HB   GLU  73          HB2       GLU  73   5.182   6.545   6.503
  533   2HB   GLU  73          HB1       GLU  73   4.750   7.152   4.910
  534   1HG   GLU  73          HG2       GLU  73   6.126   9.118   5.259
  535   2HG   GLU  73          HG1       GLU  73   6.519   8.574   6.889
  536    H    GLY  74           HN       GLY  74   3.554   5.955   7.699
  537   1HA   GLY  74          HA2       GLY  74   1.447   5.005   8.436
  538   2HA   GLY  74          HA1       GLY  74   0.693   5.740   7.030
  539    H    TRP  75           HN       TRP  75   3.041   3.292   8.009
  540    HA   TRP  75           HA       TRP  75   2.080   1.551   5.904
  541   1HB   TRP  75          HB2       TRP  75   4.460   1.054   5.179
  542   2HB   TRP  75          HB1       TRP  75   3.817   2.609   4.668
  543    HD1  TRP  75           HD1      TRP  75   5.027   4.763   5.505
  544    HE1  TRP  75           HE1      TRP  75   7.199   5.203   6.813
  545    HE3  TRP  75           HE3      TRP  75   5.959   0.003   7.133
  546    HZ2  TRP  75           HZ2      TRP  75   9.056   3.718   8.337
  547    HZ3  TRP  75           HZ3      TRP  75   7.956  -0.399   8.511
  548    HH2  TRP  75           HH2      TRP  75   9.473   1.421   9.100
  549    H    GLY  76           HN       GLY  76   2.741  -0.648   6.183
  550   1HA   GLY  76          HA2       GLY  76   3.785  -1.209   8.891
  551   2HA   GLY  76          HA1       GLY  76   2.483  -2.141   8.164
  552    H    TRP  77           HN       TRP  77   5.597  -2.322   8.932
  553    HA   TRP  77           HA       TRP  77   6.417  -3.805   6.533
  554   1HB   TRP  77          HB2       TRP  77   8.003  -2.126   7.434
  555   2HB   TRP  77          HB1       TRP  77   8.029  -2.987   8.968
  556    HD1  TRP  77           HD1      TRP  77   9.542  -5.161   9.131
  557    HE1  TRP  77           HE1      TRP  77  11.341  -6.172   7.578
  558    HE3  TRP  77           HE3      TRP  77   8.601  -2.426   4.914
  559    HZ2  TRP  77           HZ2      TRP  77  12.232  -5.840   4.925
  560    HZ3  TRP  77           HZ3      TRP  77   9.974  -2.831   2.913
  561    HH2  TRP  77           HH2      TRP  77  11.753  -4.503   2.921
  562    H    CYS  78           HN       CYS  78   6.726  -5.985   6.582
  563    HA   CYS  78           HA       CYS  78   6.146  -7.330   9.146
  564   1HB   CYS  78          HB2       CYS  78   4.430  -7.509   7.223
  565   2HB   CYS  78          HB1       CYS  78   5.616  -8.540   6.441
  566    H    TYR  79           HN       TYR  79   8.041  -8.062   9.909
  567    HA   TYR  79           HA       TYR  79  10.406  -8.253   8.515
  568   1HB   TYR  79          HB2       TYR  79   9.483  -9.514  11.070
  569   2HB   TYR  79          HB1       TYR  79  11.073  -9.901  10.419
  570    HD1  TYR  79           HD1      TYR  79  12.306  -7.610   9.536
  571    HD2  TYR  79           HD2      TYR  79   9.521  -7.910  12.742
  572    HE1  TYR  79           HE1      TYR  79  13.242  -5.570  10.531
  573    HE2  TYR  79           HE2      TYR  79  10.449  -5.859  13.738
  574    HH   TYR  79           HH       TYR  79  12.863  -4.655  13.570
  575    H    VAL  80           HN       VAL  80   8.268 -10.998   9.298
  576    HA   VAL  80           HA       VAL  80   9.912 -12.939   8.095
  577    HB   VAL  80           HB       VAL  80   7.852 -14.391   8.132
  578   1HG1  VAL  80          HG11      VAL  80   7.789 -14.508  10.585
  579   2HG1  VAL  80          HG12      VAL  80   8.624 -12.956  10.670
  580   3HG1  VAL  80          HG13      VAL  80   9.436 -14.358   9.972
  581   1HG2  VAL  80          HG21      VAL  80   6.643 -11.926   9.379
  582   2HG2  VAL  80          HG22      VAL  80   5.915 -13.532   9.388
  583   3HG2  VAL  80          HG23      VAL  80   6.155 -12.681   7.862
  584    H    ASP  81           HN       ASP  81   7.777 -10.674   6.673
  585    HA   ASP  81           HA       ASP  81   7.597 -12.239   4.191
  586   1HB   ASP  81          HB2       ASP  81   6.121  -9.749   5.076
  587   2HB   ASP  81          HB1       ASP  81   5.950 -10.483   3.487
  588    H    GLU  82           HN       GLU  82   8.885  -9.344   5.598
  589    HA   GLU  82           HA       GLU  82  10.284  -7.723   4.914
  590   1HB   GLU  82          HB2       GLU  82  10.955  -9.681   2.712
  591   2HB   GLU  82          HB1       GLU  82  11.822  -8.177   3.001
  592   1HG   GLU  82          HG2       GLU  82  12.140  -9.094   5.394
  593   2HG   GLU  82          HG1       GLU  82  11.726 -10.649   4.674
  594    H    VAL  83           HN       VAL  83   7.526  -7.875   4.009
  595    HA   VAL  83           HA       VAL  83   7.727  -6.100   1.676
  596    HB   VAL  83           HB       VAL  83   5.411  -6.621   1.137
  597   1HG1  VAL  83          HG11      VAL  83   7.049  -9.119   1.542
  598   2HG1  VAL  83          HG12      VAL  83   7.137  -8.028   0.158
  599   3HG1  VAL  83          HG13      VAL  83   5.667  -8.956   0.458
  600   1HG2  VAL  83          HG21      VAL  83   4.551  -7.016   3.378
  601   2HG2  VAL  83          HG22      VAL  83   5.495  -8.502   3.495
  602   3HG2  VAL  83          HG23      VAL  83   4.182  -8.381   2.323
  603    H    MET  84           HN       MET  84   6.325  -4.268   1.644
  604    HA   MET  84           HA       MET  84   5.497  -3.359   4.329
  605   1HB   MET  84          HB2       MET  84   7.487  -2.149   3.541
  606   2HB   MET  84          HB1       MET  84   6.654  -1.729   2.053
  607   1HG   MET  84          HG2       MET  84   4.988  -0.480   3.417
  608   2HG   MET  84          HG1       MET  84   5.988  -0.794   4.833
  609   1HE   MET  84          HE1       MET  84   8.919  -0.586   3.586
  610   2HE   MET  84          HE2       MET  84   8.474   0.151   5.125
  611   3HE   MET  84          HE3       MET  84   9.299   1.109   3.895
  612    H    PHE  85           HN       PHE  85   3.362  -2.979   4.469
  613    HA   PHE  85           HA       PHE  85   1.941  -2.416   1.956
  614   1HB   PHE  85          HB2       PHE  85  -0.099  -3.320   3.067
  615   2HB   PHE  85          HB1       PHE  85   1.170  -4.510   2.820
  616    HD1  PHE  85           HD1      PHE  85  -0.862  -2.747   5.236
  617    HD2  PHE  85           HD2      PHE  85   2.477  -5.338   4.742
  618    HE1  PHE  85           HE1      PHE  85  -1.016  -3.394   7.602
  619    HE2  PHE  85           HE2      PHE  85   2.331  -5.980   7.112
  620    HZ   PHE  85           HZ       PHE  85   0.589  -5.002   8.547
  621    H    ASP  86           HN       ASP  86  -0.082  -1.108   2.253
  622    HA   ASP  86           HA       ASP  86   0.759   1.335   3.550
  623   1HB   ASP  86          HB2       ASP  86  -0.150   1.512   1.316
  624   2HB   ASP  86          HB1       ASP  86  -1.629   0.694   1.809
  625    H    LEU  87           HN       LEU  87   0.000   2.172   5.353
  626    HA   LEU  87           HA       LEU  87  -2.562   1.233   6.432
  627   1HB   LEU  87          HB2       LEU  87   0.059   1.453   7.909
  628   2HB   LEU  87          HB1       LEU  87  -1.486   1.454   8.737
  629    HG   LEU  87           HG       LEU  87  -0.450  -0.795   7.007
  630   1HD1  LEU  87          HD11      LEU  87   0.829  -0.550   9.073
  631   2HD1  LEU  87          HD12      LEU  87  -0.172  -2.002   9.109
  632   3HD1  LEU  87          HD13      LEU  87  -0.667  -0.566  10.006
  633   1HD2  LEU  87          HD21      LEU  87  -2.888  -0.637   7.012
  634   2HD2  LEU  87          HD22      LEU  87  -2.888  -0.608   8.776
  635   3HD2  LEU  87          HD23      LEU  87  -2.342  -2.048   7.918
  636    H    SER  88           HN       SER  88  -1.572   3.605   4.940
  637    HA   SER  88           HA       SER  88  -1.024   5.784   6.586
  638   1HB   SER  88          HB2       SER  88  -0.647   5.751   4.150
  639   2HB   SER  88          HB1       SER  88  -2.389   5.788   3.886
  640    HG   SER  88           HG       SER  88  -0.999   7.781   5.345
  641    H    ASP  89           HN       ASP  89  -4.100   4.353   5.703
  642    HA   ASP  89           HA       ASP  89  -5.551   6.643   6.797
  643   1HB   ASP  89          HB2       ASP  89  -6.443   4.197   5.274
  644   2HB   ASP  89          HB1       ASP  89  -7.578   5.335   5.994
  645    H    ARG  90           HN       ARG  90  -4.142   4.018   8.094
  646    HA   ARG  90           HA       ARG  90  -6.173   3.831  10.224
  647   1HB   ARG  90          HB2       ARG  90  -4.634   1.508   9.046
  648   2HB   ARG  90          HB1       ARG  90  -5.687   1.418  10.447
  649   1HG   ARG  90          HG2       ARG  90  -7.599   2.022   9.035
  650   2HG   ARG  90          HG1       ARG  90  -6.528   2.066   7.631
  651   1HD   ARG  90          HD2       ARG  90  -5.980  -0.285   7.957
  652   2HD   ARG  90          HD1       ARG  90  -7.002  -0.338   9.391
  653    HE   ARG  90           HE       ARG  90  -7.969   0.012   6.624
  654   1HH1  ARG  90          HH11      ARG  90  -8.460  -0.942   9.960
  655   2HH1  ARG  90          HH12      ARG  90 -10.038  -1.615   9.673
  656   1HH2  ARG  90          HH21      ARG  90 -10.048  -0.855   6.237
  657   2HH2  ARG  90          HH22      ARG  90 -10.937  -1.582   7.546
  658    H    MET  91           HN       MET  91  -3.287   4.976   9.642
  659    HA   MET  91           HA       MET  91  -1.504   3.363  11.123
  660   1HB   MET  91          HB2       MET  91   0.138   5.058  10.777
  661   2HB   MET  91          HB1       MET  91  -0.819   4.923   9.310
  662   1HG   MET  91          HG2       MET  91  -1.990   6.937   9.796
  663   2HG   MET  91          HG1       MET  91  -1.293   7.018  11.414
  664   1HE   MET  91          HE1       MET  91   2.510   7.649  10.543
  665   2HE   MET  91          HE2       MET  91   1.699   6.099  10.772
  666   3HE   MET  91          HE3       MET  91   1.347   7.447  11.853
  667    H    THR  92           HN       THR  92  -0.424   3.752  13.042
  668    HA   THR  92           HA       THR  92  -1.941   5.191  15.069
  669    HB   THR  92           HB       THR  92   0.618   3.635  15.465
  670    HG1  THR  92           HG1      THR  92  -0.755   2.180  14.511
  671   1HG2  THR  92          HG21      THR  92  -1.697   4.252  17.303
  672   2HG2  THR  92          HG22      THR  92  -0.108   5.015  17.346
  673   3HG2  THR  92          HG23      THR  92  -0.274   3.301  17.726
  674    HA   PRO  93           HA       PRO  93   0.976   8.561  14.166
  675   1HB   PRO  93          HB2       PRO  93  -0.852  10.168  15.793
  676   2HB   PRO  93          HB1       PRO  93  -0.413  10.354  14.093
  677   1HG   PRO  93          HG2       PRO  93  -2.867   9.537  14.862
  678   2HG   PRO  93          HG1       PRO  93  -2.102   8.966  13.367
  679   1HD   PRO  93          HD2       PRO  93  -2.315   7.598  16.028
  680   2HD   PRO  93          HD1       PRO  93  -2.545   6.929  14.397
  681    H    HIS  94           HN       HIS  94   2.371   9.836  15.427
  682    HA   HIS  94           HA       HIS  94   3.428   8.723  17.693
  683   1HB   HIS  94          HB2       HIS  94   4.588  10.871  18.078
  684   2HB   HIS  94          HB1       HIS  94   4.656  10.358  16.398
  685    HD1  HIS  94           HD1      HIS  94   3.873  13.207  18.482
  686    HD2  HIS  94           HD2      HIS  94   2.722  11.845  14.726
  687    HE1  HIS  94           HE1      HIS  94   2.899  15.206  17.303
  688    HE2  HIS  94           HE2      HIS  94   2.370  14.395  14.974
  689    H    ASN  95           HN       ASN  95   2.967   8.617  19.753
  690    HA   ASN  95           HA       ASN  95   0.463   9.430  20.751
  691   1HB   ASN  95          HB2       ASN  95   1.664   7.464  21.580
  692   2HB   ASN  95          HB1       ASN  95   2.940   8.493  22.216
  693   1HD2  ASN  95          HD21      ASN  95   2.639   7.656  24.268
  694   2HD2  ASN  95          HD22      ASN  95   1.293   8.116  25.258
  695    H    GLY  96           HN       GLY  96   3.677  10.824  21.009
  696   1HA   GLY  96          HA2       GLY  96   2.490  13.352  21.782
  697   2HA   GLY  96          HA1       GLY  96   3.576  12.643  22.970
  698    HA   PRO  97           HA       PRO  97   6.309  15.116  20.216
  699   1HB   PRO  97          HB2       PRO  97   7.731  15.669  22.712
  700   2HB   PRO  97          HB1       PRO  97   7.021  16.802  21.559
  701   1HG   PRO  97          HG2       PRO  97   5.982  16.413  24.017
  702   2HG   PRO  97          HG1       PRO  97   4.973  16.796  22.609
  703   1HD   PRO  97          HD2       PRO  97   5.491  14.138  23.902
  704   2HD   PRO  97          HD1       PRO  97   3.959  14.823  23.312
  705    H    ILE  98           HN       ILE  98   8.148  14.325  19.347
  706    HA   ILE  98           HA       ILE  98   9.576  12.227  20.840
  707    HB   ILE  98           HB       ILE  98   8.864  12.127  17.903
  708   1HG1  ILE  98          HG12      ILE  98   7.920  10.457  20.244
  709   2HG1  ILE  98          HG11      ILE  98   6.951  11.610  19.333
  710   1HG2  ILE  98          HG21      ILE  98  10.373  10.139  19.597
  711   2HG2  ILE  98          HG22      ILE  98  11.076  11.186  18.365
  712   3HG2  ILE  98          HG23      ILE  98   9.926   9.931  17.904
  713   1HD1  ILE  98          HD11      ILE  98   8.141   9.065  18.259
  714   2HD1  ILE  98          HD12      ILE  98   7.163  10.215  17.345
  715   3HD1  ILE  98          HD13      ILE  98   6.452   9.326  18.693
  716    HA   PRO  99           HA       PRO  99  13.081  14.799  19.746
  717   1HB   PRO  99          HB2       PRO  99  14.606  12.497  20.781
  718   2HB   PRO  99          HB1       PRO  99  14.613  14.179  21.318
  719   1HG   PRO  99          HG2       PRO  99  13.481  12.241  22.786
  720   2HG   PRO  99          HG1       PRO  99  12.804  13.879  22.719
  721   1HD   PRO  99          HD2       PRO  99  11.905  11.397  21.305
  722   2HD   PRO  99          HD1       PRO  99  10.934  12.673  22.071
  723    H    ARG 100           HN       ARG 100  13.283  14.781  17.564
  724    HA   ARG 100           HA       ARG 100  13.939  12.330  16.153
  725   1HB   ARG 100          HB2       ARG 100  12.356  13.937  15.163
  726   2HB   ARG 100          HB1       ARG 100  13.610  15.168  15.153
  727   1HG   ARG 100          HG2       ARG 100  13.368  14.269  12.948
  728   2HG   ARG 100          HG1       ARG 100  14.926  13.767  13.606
  729   1HD   ARG 100          HD2       ARG 100  13.847  11.923  12.439
  730   2HD   ARG 100          HD1       ARG 100  13.988  11.577  14.161
  731    HE   ARG 100           HE       ARG 100  11.697  11.556  14.325
  732   1HH1  ARG 100          HH11      ARG 100  12.591  12.945  11.220
  733   2HH1  ARG 100          HH12      ARG 100  10.961  12.893  10.598
  734   1HH2  ARG 100          HH21      ARG 100   9.595  11.474  13.512
  735   2HH2  ARG 100          HH22      ARG 100   9.261  12.062  11.909
  736    H    TYR 101           HN       TYR 101  15.982  11.659  16.133
  737    HA   TYR 101           HA       TYR 101  18.122  13.526  16.687
  738   1HB   TYR 101          HB2       TYR 101  18.118  10.528  16.321
  739   2HB   TYR 101          HB1       TYR 101  19.553  11.474  16.702
  740    HD1  TYR 101           HD1      TYR 101  19.805  12.524  18.896
  741    HD2  TYR 101           HD2      TYR 101  16.424  10.107  17.992
  742    HE1  TYR 101           HE1      TYR 101  19.276  12.375  21.292
  743    HE2  TYR 101           HE2      TYR 101  15.886   9.954  20.384
  744    HH   TYR 101           HH       TYR 101  17.362  11.944  22.727
  745    H    VAL 102           HN       VAL 102  17.364  11.198  14.094
  746    HA   VAL 102           HA       VAL 102  18.948  12.869  12.285
  747    HB   VAL 102           HB       VAL 102  19.668  10.648  11.165
  748   1HG1  VAL 102          HG11      VAL 102  20.843  11.496  13.811
  749   2HG1  VAL 102          HG12      VAL 102  21.213  12.198  12.236
  750   3HG1  VAL 102          HG13      VAL 102  21.662  10.529  12.586
  751   1HG2  VAL 102          HG21      VAL 102  18.278   9.133  12.448
  752   2HG2  VAL 102          HG22      VAL 102  19.022   9.680  13.950
  753   3HG2  VAL 102          HG23      VAL 102  19.980   8.792  12.766
  Start of MODEL   12
    1   1H    MET   1          HT1       MET   1   4.552   0.510  -2.301
    2   2H    MET   1          HT2       MET   1   5.928  -0.395  -1.897
    3   3H    MET   1          HT3       MET   1   5.464   0.918  -0.929
    4    HA   MET   1           HA       MET   1   4.923  -1.254   0.045
    5   1HB   MET   1          HB2       MET   1   2.669  -0.674   0.733
    6   2HB   MET   1          HB1       MET   1   3.655   0.776   0.659
    7   1HG   MET   1          HG2       MET   1   1.758  -0.081  -1.512
    8   2HG   MET   1          HG1       MET   1   1.338   1.031  -0.212
    9   1HE   MET   1          HE1       MET   1   0.976   1.757  -3.286
   10   2HE   MET   1          HE2       MET   1   1.589   3.411  -3.305
   11   3HE   MET   1          HE3       MET   1   0.582   2.858  -1.967
   12    H    THR   2           HN       THR   2   3.186  -2.927   0.089
   13    HA   THR   2           HA       THR   2   2.245  -3.672  -2.586
   14    HB   THR   2           HB       THR   2   4.394  -4.859  -2.119
   15    HG1  THR   2           HG1      THR   2   2.677  -5.810  -3.421
   16   1HG2  THR   2          HG21      THR   2   2.819  -6.152   0.111
   17   2HG2  THR   2          HG22      THR   2   4.205  -5.077   0.300
   18   3HG2  THR   2          HG23      THR   2   4.414  -6.660  -0.448
   19    H    MET   3           HN       MET   3   0.947  -5.924  -2.154
   20    HA   MET   3           HA       MET   3  -1.354  -5.166  -0.672
   21   1HB   MET   3          HB2       MET   3  -1.430  -6.575  -2.705
   22   2HB   MET   3          HB1       MET   3  -0.610  -7.861  -1.831
   23   1HG   MET   3          HG2       MET   3  -2.530  -7.921  -0.251
   24   2HG   MET   3          HG1       MET   3  -3.356  -6.760  -1.289
   25   1HE   MET   3          HE1       MET   3  -1.929 -10.390  -0.962
   26   2HE   MET   3          HE2       MET   3  -1.015  -9.752  -2.329
   27   3HE   MET   3          HE3       MET   3  -2.198 -11.036  -2.581
   28    H    GLY   4           HN       GLY   4  -2.228  -6.073   1.205
   29   1HA   GLY   4          HA2       GLY   4  -0.346  -6.770   3.221
   30   2HA   GLY   4          HA1       GLY   4  -2.095  -6.775   3.387
   31    H    CYS   5           HN       CYS   5  -0.343  -8.665   4.522
   32    HA   CYS   5           HA       CYS   5  -0.869 -11.099   2.966
   33   1HB   CYS   5          HB2       CYS   5   0.836 -12.163   4.375
   34   2HB   CYS   5          HB1       CYS   5   1.481 -10.725   3.589
   35    H    ARG   6           HN       ARG   6  -1.192 -13.078   4.550
   36    HA   ARG   6           HA       ARG   6  -3.672 -12.823   5.773
   37   1HB   ARG   6          HB2       ARG   6  -3.117 -15.024   6.877
   38   2HB   ARG   6          HB1       ARG   6  -2.952 -14.985   5.128
   39   1HG   ARG   6          HG2       ARG   6  -0.562 -14.831   5.299
   40   2HG   ARG   6          HG1       ARG   6  -0.658 -14.671   7.053
   41   1HD   ARG   6          HD2       ARG   6  -1.695 -17.074   5.568
   42   2HD   ARG   6          HD1       ARG   6  -0.042 -16.960   6.170
   43    HE   ARG   6           HE       ARG   6  -1.111 -16.630   8.426
   44   1HH1  ARG   6          HH11      ARG   6  -2.740 -18.418   5.879
   45   2HH1  ARG   6          HH12      ARG   6  -3.641 -19.397   6.994
   46   1HH2  ARG   6          HH21      ARG   6  -2.281 -17.926   9.863
   47   2HH2  ARG   6          HH22      ARG   6  -3.368 -19.141   9.246
   48    H    HIS   7           HN       HIS   7  -0.524 -12.213   7.110
   49    HA   HIS   7           HA       HIS   7  -1.206 -12.413   9.847
   50   1HB   HIS   7          HB2       HIS   7   1.009 -10.846   8.513
   51   2HB   HIS   7          HB1       HIS   7   0.875 -11.118  10.247
   52    HD2  HIS   7           HD2      HIS   7   0.494 -14.215  10.526
   53    HE1  HIS   7           HE1      HIS   7   3.711 -14.587   7.804
   54    HE2  HIS   7           HE2      HIS   7   2.176 -15.835   9.385
   55    H    VAL   8           HN       VAL   8  -1.724  -9.937   7.480
   56    HA   VAL   8           HA       VAL   8  -1.959  -7.708   9.227
   57    HB   VAL   8           HB       VAL   8  -3.413  -8.065   6.608
   58   1HG1  VAL   8          HG11      VAL   8  -3.296  -5.639   6.474
   59   2HG1  VAL   8          HG12      VAL   8  -2.465  -5.585   8.028
   60   3HG1  VAL   8          HG13      VAL   8  -4.133  -6.150   7.940
   61   1HG2  VAL   8          HG21      VAL   8  -1.083  -8.578   6.287
   62   2HG2  VAL   8          HG22      VAL   8  -0.625  -7.069   7.076
   63   3HG2  VAL   8          HG23      VAL   8  -1.491  -7.035   5.540
   64    H    ALA   9           HN       ALA   9  -4.081 -10.295   8.288
   65    HA   ALA   9           HA       ALA   9  -6.478  -9.030   9.084
   66   1HB   ALA   9          HB1       ALA   9  -7.493 -11.247   8.902
   67   2HB   ALA   9          HB2       ALA   9  -5.890 -11.973   8.786
   68   3HB   ALA   9          HB3       ALA   9  -6.466 -10.898   7.511
   69    H    GLY  10           HN       GLY  10  -3.894 -10.309  10.831
   70   1HA   GLY  10          HA2       GLY  10  -5.557 -10.923  13.173
   71   2HA   GLY  10          HA1       GLY  10  -3.890 -11.427  12.945
   72    H    ILE  11           HN       ILE  11  -3.713  -8.384  11.934
   73    HA   ILE  11           HA       ILE  11  -2.775  -7.486  14.536
   74    HB   ILE  11           HB       ILE  11  -1.787  -5.573  13.385
   75   1HG1  ILE  11          HG12      ILE  11  -2.845  -6.812  10.834
   76   2HG1  ILE  11          HG11      ILE  11  -3.506  -5.369  11.593
   77   1HG2  ILE  11          HG21      ILE  11  -1.179  -8.239  12.122
   78   2HG2  ILE  11          HG22      ILE  11  -0.486  -7.590  13.608
   79   3HG2  ILE  11          HG23      ILE  11  -0.128  -6.824  12.060
   80   1HD1  ILE  11          HD11      ILE  11  -0.721  -5.672  10.496
   81   2HD1  ILE  11          HD12      ILE  11  -1.375  -4.223  11.258
   82   3HD1  ILE  11          HD13      ILE  11  -2.053  -4.803   9.736
   83    H    ARG  12           HN       ARG  12  -3.276  -5.373  15.359
   84    HA   ARG  12           HA       ARG  12  -5.996  -4.496  14.650
   85   1HB   ARG  12          HB2       ARG  12  -6.452  -4.256  17.087
   86   2HB   ARG  12          HB1       ARG  12  -6.198  -5.925  16.590
   87   1HG   ARG  12          HG2       ARG  12  -3.837  -5.718  17.368
   88   2HG   ARG  12          HG1       ARG  12  -4.250  -4.132  18.018
   89   1HD   ARG  12          HD2       ARG  12  -5.930  -5.151  19.461
   90   2HD   ARG  12          HD1       ARG  12  -5.556  -6.738  18.790
   91    HE   ARG  12           HE       ARG  12  -3.366  -5.278  20.041
   92   1HH1  ARG  12          HH11      ARG  12  -5.744  -7.831  20.253
   93   2HH1  ARG  12          HH12      ARG  12  -4.996  -8.594  21.622
   94   1HH2  ARG  12          HH21      ARG  12  -2.344  -6.300  21.805
   95   2HH2  ARG  12          HH22      ARG  12  -3.042  -7.728  22.492
   96    H    THR  13           HN       THR  13  -6.505  -2.367  15.843
   97    HA   THR  13           HA       THR  13  -4.310  -0.512  15.445
   98    HB   THR  13           HB       THR  13  -7.066   0.142  16.497
   99    HG1  THR  13           HG1      THR  13  -7.449  -0.910  14.574
  100   1HG2  THR  13          HG21      THR  13  -6.631   2.318  15.448
  101   2HG2  THR  13          HG22      THR  13  -5.045   1.750  14.926
  102   3HG2  THR  13          HG23      THR  13  -5.396   1.928  16.645
  103    H    VAL  14           HN       VAL  14  -2.873  -0.261  17.049
  104    HA   VAL  14           HA       VAL  14  -3.703  -1.021  19.749
  105    HB   VAL  14           HB       VAL  14  -1.285  -1.229  20.231
  106   1HG1  VAL  14          HG11      VAL  14  -2.208  -2.778  17.816
  107   2HG1  VAL  14          HG12      VAL  14  -2.618  -3.149  19.491
  108   3HG1  VAL  14          HG13      VAL  14  -0.944  -3.262  18.947
  109   1HG2  VAL  14          HG21      VAL  14  -0.965  -0.650  17.286
  110   2HG2  VAL  14          HG22      VAL  14   0.314  -1.186  18.376
  111   3HG2  VAL  14          HG23      VAL  14  -0.441   0.391  18.610
  112    H    THR  15           HN       THR  15  -2.639   0.071  21.550
  113    HA   THR  15           HA       THR  15  -2.441   2.966  21.089
  114    HB   THR  15           HB       THR  15  -3.010   1.494  23.677
  115    HG1  THR  15           HG1      THR  15  -4.724   1.429  22.057
  116   1HG2  THR  15          HG21      THR  15  -3.601   3.708  24.550
  117   2HG2  THR  15          HG22      THR  15  -3.143   4.442  23.013
  118   3HG2  THR  15          HG23      THR  15  -1.920   3.667  24.019
  119    HA   PRO  16           HA       PRO  16   1.924   2.339  21.625
  120   1HB   PRO  16          HB2       PRO  16   1.915   5.257  22.138
  121   2HB   PRO  16          HB1       PRO  16   2.809   4.325  20.931
  122   1HG   PRO  16          HG2       PRO  16   0.727   5.837  20.228
  123   2HG   PRO  16          HG1       PRO  16   1.022   4.266  19.460
  124   1HD   PRO  16          HD2       PRO  16  -0.960   4.999  21.578
  125   2HD   PRO  16          HD1       PRO  16  -1.153   3.926  20.175
  126    H    SER  17           HN       SER  17   2.812   1.571  23.393
  127    HA   SER  17           HA       SER  17   1.996   2.165  26.018
  128   1HB   SER  17          HB2       SER  17   3.097   0.048  25.354
  129   2HB   SER  17          HB1       SER  17   4.600   0.926  25.081
  130    HG   SER  17           HG       SER  17   4.986   0.647  27.118
  131    H    ALA  18           HN       ALA  18   4.477   3.510  23.959
  132    HA   ALA  18           HA       ALA  18   4.961   5.603  25.940
  133   1HB   ALA  18          HB1       ALA  18   6.755   3.967  26.256
  134   2HB   ALA  18          HB2       ALA  18   7.378   5.481  25.598
  135   3HB   ALA  18          HB3       ALA  18   7.164   4.083  24.544
  136    H    LEU  19           HN       LEU  19   6.135   7.470  24.946
  137    HA   LEU  19           HA       LEU  19   5.050   8.165  22.402
  138   1HB   LEU  19          HB2       LEU  19   7.003   9.438  24.283
  139   2HB   LEU  19          HB1       LEU  19   6.840  10.069  22.658
  140    HG   LEU  19           HG       LEU  19   4.448  10.501  23.077
  141   1HD1  LEU  19          HD11      LEU  19   5.064   9.629  25.894
  142   2HD1  LEU  19          HD12      LEU  19   4.014   8.790  24.752
  143   3HD1  LEU  19          HD13      LEU  19   3.567  10.388  25.351
  144   1HD2  LEU  19          HD21      LEU  19   4.773  12.377  24.624
  145   2HD2  LEU  19          HD22      LEU  19   6.068  12.266  23.432
  146   3HD2  LEU  19          HD23      LEU  19   6.340  11.712  25.084
  147    H    GLY  20           HN       GLY  20   8.255   7.256  23.544
  148   1HA   GLY  20          HA2       GLY  20   8.952   6.544  20.776
  149   2HA   GLY  20          HA1       GLY  20  10.095   7.408  21.799
  150    H    CYS  21           HN       CYS  21  11.598   5.689  21.602
  151    HA   CYS  21           HA       CYS  21  10.901   3.071  22.577
  152   1HB   CYS  21          HB2       CYS  21  12.616   3.422  20.808
  153   2HB   CYS  21          HB1       CYS  21  13.631   4.244  21.986
  154    HG   CYS  21           HG       CYS  21  14.931   2.076  22.404
  155    H    GLU  22           HN       GLU  22  10.312   3.105  24.678
  156    HA   GLU  22           HA       GLU  22  11.321   4.890  26.597
  157   1HB   GLU  22          HB2       GLU  22  10.013   3.729  28.196
  158   2HB   GLU  22          HB1       GLU  22   9.117   3.676  26.687
  159   1HG   GLU  22          HG2       GLU  22  10.800   1.429  27.772
  160   2HG   GLU  22          HG1       GLU  22   9.053   1.563  27.945
  161    H    GLU  23           HN       GLU  23  12.350   1.698  25.633
  162    HA   GLU  23           HA       GLU  23  14.020   1.103  27.807
  163   1HB   GLU  23          HB2       GLU  23  13.287  -0.275  25.651
  164   2HB   GLU  23          HB1       GLU  23  14.841   0.295  25.058
  165   1HG   GLU  23          HG2       GLU  23  15.194  -1.839  26.009
  166   2HG   GLU  23          HG1       GLU  23  15.880  -0.655  27.122
  167    H    CYS  24           HN       CYS  24  14.610   2.889  24.814
  168    HA   CYS  24           HA       CYS  24  17.355   3.385  25.312
  169   1HB   CYS  24          HB2       CYS  24  15.343   4.797  23.558
  170   2HB   CYS  24          HB1       CYS  24  17.052   5.214  23.603
  171    HG   CYS  24           HG       CYS  24  17.809   3.481  21.887
  172    H    LEU  25           HN       LEU  25  14.396   4.912  26.322
  173    HA   LEU  25           HA       LEU  25  15.502   7.399  27.114
  174   1HB   LEU  25          HB2       LEU  25  12.984   5.966  27.942
  175   2HB   LEU  25          HB1       LEU  25  13.396   7.581  28.486
  176    HG   LEU  25           HG       LEU  25  12.992   6.791  25.599
  177   1HD1  LEU  25          HD11      LEU  25  10.909   6.671  26.858
  178   2HD1  LEU  25          HD12      LEU  25  10.904   8.052  25.762
  179   3HD1  LEU  25          HD13      LEU  25  11.183   8.295  27.486
  180   1HD2  LEU  25          HD21      LEU  25  13.365   9.486  26.904
  181   2HD2  LEU  25          HD22      LEU  25  13.012   9.205  25.199
  182   3HD2  LEU  25          HD23      LEU  25  14.540   8.653  25.885
  183    H    LYS  26           HN       LYS  26  15.627   4.277  28.554
  184    HA   LYS  26           HA       LYS  26  15.800   5.193  31.272
  185   1HB   LYS  26          HB2       LYS  26  15.998   2.962  31.882
  186   2HB   LYS  26          HB1       LYS  26  15.088   2.852  30.384
  187   1HG   LYS  26          HG2       LYS  26  17.377   2.507  29.264
  188   2HG   LYS  26          HG1       LYS  26  17.958   2.176  30.896
  189   1HD   LYS  26          HD2       LYS  26  15.770   0.717  29.422
  190   2HD   LYS  26          HD1       LYS  26  17.378   0.103  29.804
  191   1HE   LYS  26          HE2       LYS  26  16.876   0.172  32.169
  192   2HE   LYS  26          HE1       LYS  26  15.304   0.901  31.840
  193   1HZ   LYS  26          HZ1       LYS  26  14.722  -1.121  30.585
  194   2HZ   LYS  26          HZ2       LYS  26  15.031  -1.434  32.226
  195   3HZ   LYS  26          HZ3       LYS  26  16.194  -1.822  31.058
  196    H    ILE  27           HN       ILE  27  17.959   5.046  28.656
  197    HA   ILE  27           HA       ILE  27  20.233   5.487  30.478
  198    HB   ILE  27           HB       ILE  27  21.708   4.467  28.734
  199   1HG1  ILE  27          HG12      ILE  27  19.078   3.496  27.588
  200   2HG1  ILE  27          HG11      ILE  27  20.157   4.661  26.830
  201   1HG2  ILE  27          HG21      ILE  27  21.076   3.235  30.737
  202   2HG2  ILE  27          HG22      ILE  27  21.213   2.153  29.351
  203   3HG2  ILE  27          HG23      ILE  27  19.622   2.648  29.930
  204   1HD1  ILE  27          HD11      ILE  27  21.876   2.951  26.629
  205   2HD1  ILE  27          HD12      ILE  27  20.378   2.450  25.841
  206   3HD1  ILE  27          HD13      ILE  27  20.812   1.784  27.415
  207    H    GLY  28           HN       GLY  28  18.274   6.906  28.272
  208   1HA   GLY  28          HA2       GLY  28  18.430   8.903  27.128
  209   2HA   GLY  28          HA1       GLY  28  20.037   9.104  27.813
  210    H    SER  29           HN       SER  29  18.681   6.604  25.696
  211    HA   SER  29           HA       SER  29  20.978   6.932  23.918
  212   1HB   SER  29          HB2       SER  29  20.519   4.662  24.702
  213   2HB   SER  29          HB1       SER  29  18.873   4.756  24.081
  214    HG   SER  29           HG       SER  29  21.308   4.572  22.664
  215    HA   PRO  30           HA       PRO  30  18.227   9.295  21.236
  216   1HB   PRO  30          HB2       PRO  30  20.649   9.404  19.559
  217   2HB   PRO  30          HB1       PRO  30  19.691  10.724  20.236
  218   1HG   PRO  30          HG2       PRO  30  22.128  10.138  21.183
  219   2HG   PRO  30          HG1       PRO  30  20.823  10.692  22.251
  220   1HD   PRO  30          HD2       PRO  30  21.848   7.912  21.790
  221   2HD   PRO  30          HD1       PRO  30  21.387   8.703  23.313
  222    H    TRP  31           HN       TRP  31  16.844   8.119  20.086
  223    HA   TRP  31           HA       TRP  31  17.750   5.896  18.469
  224   1HB   TRP  31          HB2       TRP  31  15.313   5.566  18.018
  225   2HB   TRP  31          HB1       TRP  31  15.731   5.534  19.725
  226    HD1  TRP  31           HD1      TRP  31  14.192   7.988  17.140
  227    HE1  TRP  31           HE1      TRP  31  12.546   9.524  18.392
  228    HE3  TRP  31           HE3      TRP  31  15.000   6.334  21.913
  229    HZ2  TRP  31           HZ2      TRP  31  11.697   9.965  21.040
  230    HZ3  TRP  31           HZ3      TRP  31  13.724   7.366  23.745
  231    HH2  TRP  31           HH2      TRP  31  12.108   9.145  23.315
  232    H    VAL  32           HN       VAL  32  17.252   5.680  16.228
  233    HA   VAL  32           HA       VAL  32  17.421   8.208  14.792
  234    HB   VAL  32           HB       VAL  32  17.547   5.400  13.672
  235   1HG1  VAL  32          HG11      VAL  32  18.627   6.484  11.748
  236   2HG1  VAL  32          HG12      VAL  32  18.357   8.058  12.497
  237   3HG1  VAL  32          HG13      VAL  32  16.983   7.069  12.004
  238   1HG2  VAL  32          HG21      VAL  32  19.342   5.748  15.286
  239   2HG2  VAL  32          HG22      VAL  32  19.808   7.237  14.463
  240   3HG2  VAL  32          HG23      VAL  32  19.978   5.685  13.642
  241    H    HIS  33           HN       HIS  33  15.480   5.226  14.656
  242    HA   HIS  33           HA       HIS  33  13.160   6.847  13.935
  243   1HB   HIS  33          HB2       HIS  33  14.143   4.436  12.404
  244   2HB   HIS  33          HB1       HIS  33  12.478   4.998  12.307
  245    HD1  HIS  33           HD1      HIS  33  12.287   7.646  11.539
  246    HD2  HIS  33           HD2      HIS  33  15.785   5.600  10.583
  247    HE1  HIS  33           HE1      HIS  33  13.376   8.975   9.699
  248    HE2  HIS  33           HE2      HIS  33  15.596   7.850   9.314
  249    H    LEU  34           HN       LEU  34  11.112   5.433  14.056
  250    HA   LEU  34           HA       LEU  34  11.358   3.590  16.353
  251   1HB   LEU  34          HB2       LEU  34   9.304   5.771  15.980
  252   2HB   LEU  34          HB1       LEU  34   9.255   4.558  17.244
  253    HG   LEU  34           HG       LEU  34  11.418   6.635  16.918
  254   1HD1  LEU  34          HD11      LEU  34   9.138   6.452  18.878
  255   2HD1  LEU  34          HD12      LEU  34   9.296   7.624  17.570
  256   3HD1  LEU  34          HD13      LEU  34  10.437   7.645  18.915
  257   1HD2  LEU  34          HD21      LEU  34  10.908   4.628  19.110
  258   2HD2  LEU  34          HD22      LEU  34  12.147   5.883  19.123
  259   3HD2  LEU  34          HD23      LEU  34  12.228   4.576  17.941
  260    H    ARG  35           HN       ARG  35  10.193   1.771  16.230
  261    HA   ARG  35           HA       ARG  35   8.046   1.608  14.225
  262   1HB   ARG  35          HB2       ARG  35  10.106  -0.543  14.766
  263   2HB   ARG  35          HB1       ARG  35   8.756  -0.669  13.648
  264   1HG   ARG  35          HG2       ARG  35   9.735   1.194  12.334
  265   2HG   ARG  35          HG1       ARG  35  11.130   1.169  13.415
  266   1HD   ARG  35          HD2       ARG  35  11.495  -1.205  12.804
  267   2HD   ARG  35          HD1       ARG  35  10.176  -1.073  11.642
  268    HE   ARG  35           HE       ARG  35  12.569   0.631  11.442
  269   1HH1  ARG  35          HH11      ARG  35  10.325  -1.661  10.039
  270   2HH1  ARG  35          HH12      ARG  35  11.041  -1.581   8.455
  271   1HH2  ARG  35          HH21      ARG  35  13.522   0.714   9.362
  272   2HH2  ARG  35          HH22      ARG  35  12.838  -0.233   8.075
  273    H    ILE  36           HN       ILE  36   6.220   0.639  14.924
  274    HA   ILE  36           HA       ILE  36   6.280  -0.608  17.601
  275    HB   ILE  36           HB       ILE  36   5.356   1.635  17.794
  276   1HG1  ILE  36          HG12      ILE  36   3.193  -0.478  17.937
  277   2HG1  ILE  36          HG11      ILE  36   4.368  -0.114  19.197
  278   1HG2  ILE  36          HG21      ILE  36   3.323   2.302  16.605
  279   2HG2  ILE  36          HG22      ILE  36   3.357   0.788  15.702
  280   3HG2  ILE  36          HG23      ILE  36   4.651   1.969  15.493
  281   1HD1  ILE  36          HD11      ILE  36   2.240   1.760  18.185
  282   2HD1  ILE  36          HD12      ILE  36   3.407   2.107  19.461
  283   3HD1  ILE  36          HD13      ILE  36   2.194   0.849  19.695
  284    H    CYS  37           HN       CYS  37   5.124  -2.503  17.818
  285    HA   CYS  37           HA       CYS  37   4.208  -3.856  15.488
  286   1HB   CYS  37          HB2       CYS  37   3.410  -4.495  18.325
  287   2HB   CYS  37          HB1       CYS  37   3.355  -5.575  16.944
  288    H    ARG  38           HN       ARG  38   2.139  -4.223  14.740
  289    HA   ARG  38           HA       ARG  38  -0.003  -2.557  15.776
  290   1HB   ARG  38          HB2       ARG  38   0.111  -4.553  13.504
  291   2HB   ARG  38          HB1       ARG  38  -1.318  -3.615  13.919
  292   1HG   ARG  38          HG2       ARG  38   1.333  -2.452  13.088
  293   2HG   ARG  38          HG1       ARG  38  -0.065  -2.664  12.032
  294   1HD   ARG  38          HD2       ARG  38   0.064  -0.948  14.510
  295   2HD   ARG  38          HD1       ARG  38   0.059  -0.375  12.842
  296    HE   ARG  38           HE       ARG  38  -2.213  -1.906  13.920
  297   1HH1  ARG  38          HH11      ARG  38  -0.904   1.001  12.450
  298   2HH1  ARG  38          HH12      ARG  38  -2.474   1.662  12.101
  299   1HH2  ARG  38          HH21      ARG  38  -4.268  -1.008  13.456
  300   2HH2  ARG  38          HH22      ARG  38  -4.367   0.542  12.685
  301    H    THR  39           HN       THR  39   1.000  -4.432  17.609
  302    HA   THR  39           HA       THR  39  -1.286  -6.221  17.965
  303    HB   THR  39           HB       THR  39   1.482  -7.276  18.476
  304    HG1  THR  39           HG1      THR  39   0.208  -8.014  16.106
  305   1HG2  THR  39          HG21      THR  39  -1.169  -8.582  17.849
  306   2HG2  THR  39          HG22      THR  39  -0.397  -8.493  19.433
  307   3HG2  THR  39          HG23      THR  39   0.347  -9.435  18.140
  308    H    CYS  40           HN       CYS  40   1.872  -5.618  19.556
  309    HA   CYS  40           HA       CYS  40   0.527  -5.769  22.127
  310   1HB   CYS  40          HB2       CYS  40   2.696  -6.013  23.113
  311   2HB   CYS  40          HB1       CYS  40   2.652  -7.026  21.677
  312    H    GLY  41           HN       GLY  41   1.752  -3.335  20.029
  313   1HA   GLY  41          HA2       GLY  41   1.501  -1.045  20.220
  314   2HA   GLY  41          HA1       GLY  41   0.841  -1.293  21.827
  315    H    HIS  42           HN       HIS  42   3.850  -2.806  21.394
  316    HA   HIS  42           HA       HIS  42   5.117  -0.841  23.109
  317   1HB   HIS  42          HB2       HIS  42   5.321  -3.393  23.383
  318   2HB   HIS  42          HB1       HIS  42   6.416  -3.333  22.008
  319    HD1  HIS  42           HD1      HIS  42   6.865  -3.918  25.264
  320    HD2  HIS  42           HD2      HIS  42   8.256  -0.786  22.910
  321    HE1  HIS  42           HE1      HIS  42   8.882  -3.010  26.460
  322    HE2  HIS  42           HE2      HIS  42   9.531  -0.955  25.148
  323    H    VAL  43           HN       VAL  43   6.473   0.684  22.428
  324    HA   VAL  43           HA       VAL  43   7.106   0.841  19.593
  325    HB   VAL  43           HB       VAL  43   7.751   2.842  21.772
  326   1HG1  VAL  43          HG11      VAL  43   9.058   3.100  19.719
  327   2HG1  VAL  43          HG12      VAL  43   7.928   4.437  19.936
  328   3HG1  VAL  43          HG13      VAL  43   7.569   3.158  18.776
  329   1HG2  VAL  43          HG21      VAL  43   5.339   2.448  21.680
  330   2HG2  VAL  43          HG22      VAL  43   5.350   2.760  19.944
  331   3HG2  VAL  43          HG23      VAL  43   5.747   4.053  21.075
  332    H    GLY  44           HN       GLY  44   9.065   0.428  18.746
  333   1HA   GLY  44          HA2       GLY  44  11.356   0.248  20.603
  334   2HA   GLY  44          HA1       GLY  44  11.078  -0.973  19.368
  335    H    CYS  45           HN       CYS  45  13.364   0.884  19.780
  336    HA   CYS  45           HA       CYS  45  13.244   2.799  17.677
  337   1HB   CYS  45          HB2       CYS  45  15.636   3.105  18.068
  338   2HB   CYS  45          HB1       CYS  45  14.755   3.094  19.590
  339    HG   CYS  45           HG       CYS  45  17.360   1.399  18.807
  340    H    CYS  46           HN       CYS  46  14.021   2.701  15.644
  341    HA   CYS  46           HA       CYS  46  13.796   0.280  14.270
  342   1HB   CYS  46          HB2       CYS  46  13.425   2.554  13.329
  343   2HB   CYS  46          HB1       CYS  46  15.164   2.813  13.352
  344    HG   CYS  46           HG       CYS  46  15.450   2.028  10.947
  345    H    ASP  47           HN       ASP  47  15.491  -0.616  12.773
  346    HA   ASP  47           HA       ASP  47  17.630  -1.546  14.410
  347   1HB   ASP  47          HB2       ASP  47  18.187  -3.008  12.560
  348   2HB   ASP  47          HB1       ASP  47  16.444  -2.999  12.795
  349    H    ASP  48           HN       ASP  48  17.323   1.191  12.545
  350    HA   ASP  48           HA       ASP  48  19.884   1.548  11.469
  351   1HB   ASP  48          HB2       ASP  48  18.048   3.625  12.694
  352   2HB   ASP  48          HB1       ASP  48  19.450   3.981  11.695
  353    H    SER  49           HN       SER  49  18.589   2.310  14.671
  354    HA   SER  49           HA       SER  49  21.144   3.138  15.704
  355   1HB   SER  49          HB2       SER  49  19.897   3.216  17.887
  356   2HB   SER  49          HB1       SER  49  19.158   4.180  16.609
  357    HG   SER  49           HG       SER  49  18.134   1.740  16.447
  358    HA   PRO  50           HA       PRO  50  22.811  -0.816  16.630
  359   1HB   PRO  50          HB2       PRO  50  24.198  -0.213  18.936
  360   2HB   PRO  50          HB1       PRO  50  24.770   0.130  17.301
  361   1HG   PRO  50          HG2       PRO  50  23.424   1.947  19.258
  362   2HG   PRO  50          HG1       PRO  50  24.785   2.280  18.171
  363   1HD   PRO  50          HD2       PRO  50  22.306   3.116  17.597
  364   2HD   PRO  50          HD1       PRO  50  23.408   2.549  16.325
  365    H    HIS  51           HN       HIS  51  20.852   0.830  18.959
  366    HA   HIS  51           HA       HIS  51  20.724  -1.197  20.930
  367   1HB   HIS  51          HB2       HIS  51  19.984   1.254  21.122
  368   2HB   HIS  51          HB1       HIS  51  18.502   0.753  20.315
  369    HD1  HIS  51           HD1      HIS  51  20.060   1.002  23.584
  370    HD2  HIS  51           HD2      HIS  51  17.034  -1.278  21.871
  371    HE1  HIS  51           HE1      HIS  51  18.729   0.081  25.510
  372    HE2  HIS  51           HE2      HIS  51  17.121  -1.542  24.443
  373    H    LYS  52           HN       LYS  52  18.964  -0.559  17.971
  374    HA   LYS  52           HA       LYS  52  17.324  -1.669  16.838
  375   1HB   LYS  52          HB2       LYS  52  19.163  -3.909  17.674
  376   2HB   LYS  52          HB1       LYS  52  17.930  -4.058  16.430
  377   1HG   LYS  52          HG2       LYS  52  19.029  -2.249  15.168
  378   2HG   LYS  52          HG1       LYS  52  20.297  -2.202  16.388
  379   1HD   LYS  52          HD2       LYS  52  19.592  -4.662  14.806
  380   2HD   LYS  52          HD1       LYS  52  20.841  -3.514  14.322
  381   1HE   LYS  52          HE2       LYS  52  21.970  -3.908  16.493
  382   2HE   LYS  52          HE1       LYS  52  20.764  -5.143  16.856
  383   1HZ   LYS  52          HZ1       LYS  52  22.868  -6.022  15.932
  384   2HZ   LYS  52          HZ2       LYS  52  22.540  -5.209  14.482
  385   3HZ   LYS  52          HZ3       LYS  52  21.505  -6.439  15.011
  386    H    HIS  53           HN       HIS  53  16.104  -1.076  19.072
  387    HA   HIS  53           HA       HIS  53  15.304  -3.328  20.639
  388   1HB   HIS  53          HB2       HIS  53  15.385  -0.922  21.433
  389   2HB   HIS  53          HB1       HIS  53  13.918  -0.649  20.503
  390    HD1  HIS  53           HD1      HIS  53  12.154  -0.381  22.256
  391    HD2  HIS  53           HD2      HIS  53  14.619  -3.648  22.993
  392    HE1  HIS  53           HE1      HIS  53  11.165  -1.536  24.254
  393    HE2  HIS  53           HE2      HIS  53  12.589  -3.586  24.599
  394    H    ALA  54           HN       ALA  54  14.278  -2.014  17.651
  395    HA   ALA  54           HA       ALA  54  11.607  -3.057  17.723
  396   1HB   ALA  54          HB1       ALA  54  12.197  -1.173  16.278
  397   2HB   ALA  54          HB2       ALA  54  11.536  -2.518  15.349
  398   3HB   ALA  54          HB3       ALA  54  13.275  -2.219  15.354
  399    H    THR  55           HN       THR  55  14.687  -4.148  16.325
  400    HA   THR  55           HA       THR  55  13.485  -6.430  15.075
  401    HB   THR  55           HB       THR  55  15.921  -7.066  14.654
  402    HG1  THR  55           HG1      THR  55  17.451  -5.522  15.132
  403   1HG2  THR  55          HG21      THR  55  14.927  -4.381  13.693
  404   2HG2  THR  55          HG22      THR  55  14.547  -5.947  12.975
  405   3HG2  THR  55          HG23      THR  55  16.201  -5.336  12.934
  406    H    ARG  56           HN       ARG  56  15.695  -5.961  17.831
  407    HA   ARG  56           HA       ARG  56  15.910  -8.664  18.548
  408   1HB   ARG  56          HB2       ARG  56  16.113  -6.179  20.258
  409   2HB   ARG  56          HB1       ARG  56  16.560  -7.791  20.802
  410   1HG   ARG  56          HG2       ARG  56  18.254  -7.917  19.047
  411   2HG   ARG  56          HG1       ARG  56  17.806  -6.302  18.500
  412   1HD   ARG  56          HD2       ARG  56  18.502  -5.356  20.617
  413   2HD   ARG  56          HD1       ARG  56  18.851  -6.966  21.250
  414    HE   ARG  56           HE       ARG  56  20.378  -6.762  18.983
  415   1HH1  ARG  56          HH11      ARG  56  20.085  -4.889  21.935
  416   2HH1  ARG  56          HH12      ARG  56  21.746  -4.390  21.924
  417   1HH2  ARG  56          HH21      ARG  56  22.570  -6.082  18.985
  418   2HH2  ARG  56          HH22      ARG  56  23.141  -5.048  20.261
  419    H    HIS  57           HN       HIS  57  13.502  -6.243  19.288
  420    HA   HIS  57           HA       HIS  57  12.052  -7.634  21.244
  421   1HB   HIS  57          HB2       HIS  57  11.635  -5.297  20.877
  422   2HB   HIS  57          HB1       HIS  57  11.195  -5.581  19.199
  423    HD1  HIS  57           HD1      HIS  57   9.806  -5.649  22.665
  424    HD2  HIS  57           HD2      HIS  57   8.648  -6.631  18.794
  425    HE1  HIS  57           HE1      HIS  57   7.285  -5.951  22.719
  426    H    PHE  58           HN       PHE  58  11.755  -7.615  17.696
  427    HA   PHE  58           HA       PHE  58   9.558  -9.363  17.517
  428   1HB   PHE  58          HB2       PHE  58  10.137  -8.211  15.539
  429   2HB   PHE  58          HB1       PHE  58  11.816  -8.737  15.625
  430    HD1  PHE  58           HD1      PHE  58   8.447 -10.364  15.531
  431    HD2  PHE  58           HD2      PHE  58  12.424 -10.268  14.048
  432    HE1  PHE  58           HE1      PHE  58   7.937 -12.261  14.052
  433    HE2  PHE  58           HE2      PHE  58  11.929 -12.166  12.566
  434    HZ   PHE  58           HZ       PHE  58   9.679 -13.165  12.567
  435    H    HIS  59           HN       HIS  59  13.031  -9.957  17.583
  436    HA   HIS  59           HA       HIS  59  12.983 -12.716  17.138
  437   1HB   HIS  59          HB2       HIS  59  15.014 -11.339  16.996
  438   2HB   HIS  59          HB1       HIS  59  14.967 -11.082  18.735
  439    HD1  HIS  59           HD1      HIS  59  15.142 -14.077  16.369
  440    HD2  HIS  59           HD2      HIS  59  16.575 -12.790  20.059
  441    HE1  HIS  59           HE1      HIS  59  16.703 -15.883  17.162
  442    HE2  HIS  59           HE2      HIS  59  17.687 -15.003  19.310
  443    H    ALA  60           HN       ALA  60  12.355 -10.860  20.024
  444    HA   ALA  60           HA       ALA  60  12.421 -13.221  21.716
  445   1HB   ALA  60          HB1       ALA  60  13.287 -11.137  22.609
  446   2HB   ALA  60          HB2       ALA  60  11.882 -11.666  23.535
  447   3HB   ALA  60          HB3       ALA  60  11.724 -10.359  22.361
  448    H    THR  61           HN       THR  61   9.990 -10.793  20.746
  449    HA   THR  61           HA       THR  61   7.910 -12.203  22.146
  450    HB   THR  61           HB       THR  61   6.412 -10.441  21.213
  451    HG1  THR  61           HG1      THR  61   8.837  -9.370  20.143
  452   1HG2  THR  61          HG21      THR  61   8.936  -9.436  22.534
  453   2HG2  THR  61          HG22      THR  61   7.542 -10.131  23.362
  454   3HG2  THR  61          HG23      THR  61   7.383  -8.600  22.501
  455    H    GLY  62           HN       GLY  62   8.827 -11.777  18.758
  456   1HA   GLY  62          HA2       GLY  62   8.216 -13.176  16.982
  457   2HA   GLY  62          HA1       GLY  62   7.009 -13.927  18.018
  458    H    HIS  63           HN       HIS  63   7.422 -10.474  17.418
  459    HA   HIS  63           HA       HIS  63   4.736 -10.442  16.211
  460   1HB   HIS  63          HB2       HIS  63   6.261  -8.223  17.598
  461   2HB   HIS  63          HB1       HIS  63   4.689  -8.027  16.830
  462    HD2  HIS  63           HD2      HIS  63   3.610 -10.976  18.156
  463    HE1  HIS  63           HE1      HIS  63   3.971  -8.714  21.708
  464    HE2  HIS  63           HE2      HIS  63   2.774 -10.647  20.586
  465    HA   PRO  64           HA       PRO  64   7.536  -9.789  12.744
  466   1HB   PRO  64          HB2       PRO  64   5.902 -10.693  10.804
  467   2HB   PRO  64          HB1       PRO  64   6.735 -11.779  11.921
  468   1HG   PRO  64          HG2       PRO  64   3.901 -10.821  11.971
  469   2HG   PRO  64          HG1       PRO  64   4.539 -12.446  12.280
  470   1HD   PRO  64          HD2       PRO  64   3.844 -10.693  14.259
  471   2HD   PRO  64          HD1       PRO  64   5.075 -11.955  14.453
  472    H    ILE  65           HN       ILE  65   4.375  -8.358  13.165
  473    HA   ILE  65           HA       ILE  65   4.890  -6.611  10.867
  474    HB   ILE  65           HB       ILE  65   2.303  -7.105  12.336
  475   1HG1  ILE  65          HG12      ILE  65   3.250  -7.759   9.536
  476   2HG1  ILE  65          HG11      ILE  65   2.969  -8.912  10.834
  477   1HG2  ILE  65          HG21      ILE  65   2.365  -4.786  11.685
  478   2HG2  ILE  65          HG22      ILE  65   1.302  -5.650  10.573
  479   3HG2  ILE  65          HG23      ILE  65   2.936  -5.210  10.071
  480   1HD1  ILE  65          HD11      ILE  65   0.588  -8.352  10.797
  481   2HD1  ILE  65          HD12      ILE  65   1.156  -8.946   9.237
  482   3HD1  ILE  65          HD13      ILE  65   0.884  -7.220   9.478
  483    H    ILE  66           HN       ILE  66   5.653  -4.722  11.178
  484    HA   ILE  66           HA       ILE  66   5.028  -3.254  13.650
  485    HB   ILE  66           HB       ILE  66   7.331  -2.293  13.546
  486   1HG1  ILE  66          HG12      ILE  66   7.765  -4.518  11.538
  487   2HG1  ILE  66          HG11      ILE  66   7.805  -2.793  11.190
  488   1HG2  ILE  66          HG21      ILE  66   7.152  -5.278  13.910
  489   2HG2  ILE  66          HG22      ILE  66   6.789  -4.055  15.126
  490   3HG2  ILE  66          HG23      ILE  66   8.439  -4.246  14.535
  491   1HD1  ILE  66          HD11      ILE  66  10.037  -3.634  11.321
  492   2HD1  ILE  66          HD12      ILE  66   9.725  -4.335  12.909
  493   3HD1  ILE  66          HD13      ILE  66   9.740  -2.584  12.707
  494    H    GLU  67           HN       GLU  67   4.529  -1.143  13.377
  495    HA   GLU  67           HA       GLU  67   4.456  -0.154  10.615
  496   1HB   GLU  67          HB2       GLU  67   2.285  -0.290  11.713
  497   2HB   GLU  67          HB1       GLU  67   2.878   0.664  13.064
  498   1HG   GLU  67          HG2       GLU  67   3.044   2.615  11.710
  499   2HG   GLU  67          HG1       GLU  67   2.721   1.692  10.242
  500    H    GLY  68           HN       GLY  68   5.338   1.815  10.080
  501   1HA   GLY  68          HA2       GLY  68   7.488   2.800  11.658
  502   2HA   GLY  68          HA1       GLY  68   6.831   3.564  10.215
  503    H    TYR  69           HN       TYR  69   7.232   3.875  13.505
  504    HA   TYR  69           HA       TYR  69   4.703   5.232  13.975
  505   1HB   TYR  69          HB2       TYR  69   5.672   3.592  15.619
  506   2HB   TYR  69          HB1       TYR  69   6.943   4.767  15.945
  507    HD1  TYR  69           HD1      TYR  69   3.229   4.932  15.576
  508    HD2  TYR  69           HD2      TYR  69   6.632   5.854  17.957
  509    HE1  TYR  69           HE1      TYR  69   1.771   6.025  17.221
  510    HE2  TYR  69           HE2      TYR  69   5.179   6.951  19.613
  511    HH   TYR  69           HH       TYR  69   1.762   6.649  19.529
  512    H    ASP  70           HN       ASP  70   8.149   5.989  13.800
  513    HA   ASP  70           HA       ASP  70   7.696   8.701  14.648
  514   1HB   ASP  70          HB2       ASP  70  10.005   9.036  14.609
  515   2HB   ASP  70          HB1       ASP  70   9.833   7.348  15.063
  516    HA   PRO  71           HA       PRO  71   7.978   9.729  10.064
  517   1HB   PRO  71          HB2       PRO  71   7.742   7.581   8.281
  518   2HB   PRO  71          HB1       PRO  71   9.235   8.415   8.709
  519   1HG   PRO  71          HG2       PRO  71   8.560   5.742   9.306
  520   2HG   PRO  71          HG1       PRO  71   9.943   6.654   9.933
  521   1HD   PRO  71          HD2       PRO  71   7.312   6.089  11.198
  522   2HD   PRO  71          HD1       PRO  71   8.908   6.301  11.948
  523    HA   PRO  72           HA       PRO  72   3.474   9.422  10.021
  524   1HB   PRO  72          HB2       PRO  72   3.642  11.866   8.411
  525   2HB   PRO  72          HB1       PRO  72   2.919  11.626  10.003
  526   1HG   PRO  72          HG2       PRO  72   5.179  13.050   9.664
  527   2HG   PRO  72          HG1       PRO  72   4.892  12.067  11.113
  528   1HD   PRO  72          HD2       PRO  72   6.548  11.436   8.694
  529   2HD   PRO  72          HD1       PRO  72   6.923  11.180  10.413
  530    H    GLU  73           HN       GLU  73   4.712   7.743   8.244
  531    HA   GLU  73           HA       GLU  73   3.713   8.438   5.577
  532   1HB   GLU  73          HB2       GLU  73   5.373   6.051   6.410
  533   2HB   GLU  73          HB1       GLU  73   5.058   6.597   4.768
  534   1HG   GLU  73          HG2       GLU  73   6.311   8.642   5.197
  535   2HG   GLU  73          HG1       GLU  73   6.610   8.115   6.852
  536    H    GLY  74           HN       GLY  74   3.611   5.737   7.901
  537   1HA   GLY  74          HA2       GLY  74   1.692   4.552   8.543
  538   2HA   GLY  74          HA1       GLY  74   0.822   5.277   7.199
  539    H    TRP  75           HN       TRP  75   3.107   2.773   8.113
  540    HA   TRP  75           HA       TRP  75   2.082   1.072   6.025
  541   1HB   TRP  75          HB2       TRP  75   4.422   0.514   5.206
  542   2HB   TRP  75          HB1       TRP  75   3.774   2.066   4.692
  543    HD1  TRP  75           HD1      TRP  75   5.100   4.196   5.334
  544    HE1  TRP  75           HE1      TRP  75   7.326   4.643   6.544
  545    HE3  TRP  75           HE3      TRP  75   5.941  -0.486   7.220
  546    HZ2  TRP  75           HZ2      TRP  75   9.185   3.195   8.098
  547    HZ3  TRP  75           HZ3      TRP  75   7.971  -0.868   8.557
  548    HH2  TRP  75           HH2      TRP  75   9.558   0.936   8.986
  549    H    GLY  76           HN       GLY  76   2.671  -1.133   6.294
  550   1HA   GLY  76          HA2       GLY  76   3.705  -1.711   9.001
  551   2HA   GLY  76          HA1       GLY  76   2.434  -2.644   8.222
  552    H    TRP  77           HN       TRP  77   5.565  -2.729   9.046
  553    HA   TRP  77           HA       TRP  77   6.474  -4.168   6.663
  554   1HB   TRP  77          HB2       TRP  77   8.067  -2.579   7.577
  555   2HB   TRP  77          HB1       TRP  77   7.928  -3.303   9.175
  556    HD1  TRP  77           HD1      TRP  77   9.560  -5.233   9.740
  557    HE1  TRP  77           HE1      TRP  77  11.365  -6.525   8.434
  558    HE3  TRP  77           HE3      TRP  77   8.578  -3.476   5.043
  559    HZ2  TRP  77           HZ2      TRP  77  12.254  -6.765   5.768
  560    HZ3  TRP  77           HZ3      TRP  77   9.951  -4.286   3.170
  561    HH2  TRP  77           HH2      TRP  77  11.751  -5.897   3.527
  562    H    CYS  78           HN       CYS  78   6.588  -6.333   6.597
  563    HA   CYS  78           HA       CYS  78   5.983  -7.770   9.099
  564   1HB   CYS  78          HB2       CYS  78   4.403  -7.869   7.011
  565   2HB   CYS  78          HB1       CYS  78   5.609  -8.977   6.380
  566    H    TYR  79           HN       TYR  79   7.878  -8.381   9.920
  567    HA   TYR  79           HA       TYR  79  10.326  -8.534   8.771
  568   1HB   TYR  79          HB2       TYR  79   9.158 -10.065  11.068
  569   2HB   TYR  79          HB1       TYR  79  10.824 -10.329  10.574
  570    HD1  TYR  79           HD1      TYR  79  12.309  -8.187  10.413
  571    HD2  TYR  79           HD2      TYR  79   8.685  -8.411  12.633
  572    HE1  TYR  79           HE1      TYR  79  13.049  -6.299  11.803
  573    HE2  TYR  79           HE2      TYR  79   9.411  -6.519  14.019
  574    HH   TYR  79           HH       TYR  79  11.534  -5.454  14.707
  575    H    VAL  80           HN       VAL  80   8.437 -11.508   9.390
  576    HA   VAL  80           HA       VAL  80  10.297 -13.138   8.030
  577    HB   VAL  80           HB       VAL  80   8.595 -14.935   8.229
  578   1HG1  VAL  80          HG11      VAL  80   9.045 -13.307  10.727
  579   2HG1  VAL  80          HG12      VAL  80  10.168 -14.478  10.038
  580   3HG1  VAL  80          HG13      VAL  80   8.612 -15.015  10.672
  581   1HG2  VAL  80          HG21      VAL  80   6.579 -13.588   7.943
  582   2HG2  VAL  80          HG22      VAL  80   6.901 -12.768   9.470
  583   3HG2  VAL  80          HG23      VAL  80   6.524 -14.491   9.457
  584    H    ASP  81           HN       ASP  81   7.611 -11.315   6.875
  585    HA   ASP  81           HA       ASP  81   7.350 -12.843   4.417
  586   1HB   ASP  81          HB2       ASP  81   6.124 -10.181   5.173
  587   2HB   ASP  81          HB1       ASP  81   5.714 -11.131   3.755
  588    H    GLU  82           HN       GLU  82   8.828  -9.941   5.618
  589    HA   GLU  82           HA       GLU  82  10.360  -8.505   4.791
  590   1HB   GLU  82          HB2       GLU  82  10.618 -10.532   2.561
  591   2HB   GLU  82          HB1       GLU  82  11.698  -9.165   2.811
  592   1HG   GLU  82          HG2       GLU  82  12.319 -10.063   5.002
  593   2HG   GLU  82          HG1       GLU  82  11.259 -11.446   4.727
  594    H    VAL  83           HN       VAL  83   7.519  -8.429   4.120
  595    HA   VAL  83           HA       VAL  83   7.671  -6.748   1.711
  596    HB   VAL  83           HB       VAL  83   5.310  -7.182   1.306
  597   1HG1  VAL  83          HG11      VAL  83   6.933  -8.667   0.270
  598   2HG1  VAL  83          HG12      VAL  83   5.446  -9.534   0.655
  599   3HG1  VAL  83          HG13      VAL  83   6.872  -9.733   1.674
  600   1HG2  VAL  83          HG21      VAL  83   4.074  -8.866   2.594
  601   2HG2  VAL  83          HG22      VAL  83   4.563  -7.504   3.603
  602   3HG2  VAL  83          HG23      VAL  83   5.446  -9.028   3.692
  603    H    MET  84           HN       MET  84   6.423  -4.824   1.717
  604    HA   MET  84           HA       MET  84   5.615  -3.895   4.394
  605   1HB   MET  84          HB2       MET  84   7.679  -2.780   3.664
  606   2HB   MET  84          HB1       MET  84   6.892  -2.283   2.173
  607   1HG   MET  84          HG2       MET  84   5.297  -0.948   3.483
  608   2HG   MET  84          HG1       MET  84   6.150  -1.408   4.955
  609   1HE   MET  84          HE1       MET  84   9.169  -1.382   4.026
  610   2HE   MET  84          HE2       MET  84   8.633  -0.640   5.534
  611   3HE   MET  84          HE3       MET  84   9.650   0.269   4.416
  612    H    PHE  85           HN       PHE  85   3.473  -3.718   4.442
  613    HA   PHE  85           HA       PHE  85   2.090  -2.926   1.975
  614   1HB   PHE  85          HB2       PHE  85   0.030  -3.810   3.101
  615   2HB   PHE  85          HB1       PHE  85   1.258  -5.025   2.775
  616    HD1  PHE  85           HD1      PHE  85  -0.596  -3.235   5.333
  617    HD2  PHE  85           HD2      PHE  85   2.551  -6.005   4.609
  618    HE1  PHE  85           HE1      PHE  85  -0.670  -3.932   7.688
  619    HE2  PHE  85           HE2      PHE  85   2.483  -6.703   6.968
  620    HZ   PHE  85           HZ       PHE  85   0.876  -5.660   8.511
  621    H    ASP  86           HN       ASP  86   0.228  -1.458   2.227
  622    HA   ASP  86           HA       ASP  86   1.124   0.812   3.773
  623   1HB   ASP  86          HB2       ASP  86   0.327   1.066   1.436
  624   2HB   ASP  86          HB1       ASP  86  -1.280   0.564   1.951
  625    H    LEU  87           HN       LEU  87   0.225   1.644   5.558
  626    HA   LEU  87           HA       LEU  87  -2.382   0.619   6.450
  627   1HB   LEU  87          HB2       LEU  87   0.155   0.818   8.058
  628   2HB   LEU  87          HB1       LEU  87  -1.422   0.793   8.819
  629    HG   LEU  87           HG       LEU  87  -0.267  -1.404   7.101
  630   1HD1  LEU  87          HD11      LEU  87  -0.181  -2.662   9.201
  631   2HD1  LEU  87          HD12      LEU  87  -0.727  -1.233  10.077
  632   3HD1  LEU  87          HD13      LEU  87   0.837  -1.223   9.263
  633   1HD2  LEU  87          HD21      LEU  87  -2.854  -1.259   8.649
  634   2HD2  LEU  87          HD22      LEU  87  -2.227  -2.687   7.826
  635   3HD2  LEU  87          HD23      LEU  87  -2.693  -1.264   6.893
  636    H    SER  88           HN       SER  88  -1.272   3.147   5.183
  637    HA   SER  88           HA       SER  88  -0.987   5.161   7.123
  638   1HB   SER  88          HB2       SER  88  -1.349   6.730   5.206
  639   2HB   SER  88          HB1       SER  88  -0.136   5.489   4.892
  640    HG   SER  88           HG       SER  88  -1.656   4.346   3.679
  641    H    ASP  89           HN       ASP  89  -3.818   3.791   5.639
  642    HA   ASP  89           HA       ASP  89  -5.547   5.953   6.468
  643   1HB   ASP  89          HB2       ASP  89  -6.175   3.259   5.245
  644   2HB   ASP  89          HB1       ASP  89  -7.369   4.509   5.573
  645    H    ARG  90           HN       ARG  90  -4.126   3.441   8.074
  646    HA   ARG  90           HA       ARG  90  -6.227   3.437  10.131
  647   1HB   ARG  90          HB2       ARG  90  -4.775   0.926   9.276
  648   2HB   ARG  90          HB1       ARG  90  -6.090   1.052  10.434
  649   1HG   ARG  90          HG2       ARG  90  -7.616   1.679   8.630
  650   2HG   ARG  90          HG1       ARG  90  -6.292   1.546   7.471
  651   1HD   ARG  90          HD2       ARG  90  -6.022  -0.839   8.205
  652   2HD   ARG  90          HD1       ARG  90  -7.510  -0.651   9.131
  653    HE   ARG  90           HE       ARG  90  -7.509  -0.127   6.238
  654   1HH1  ARG  90          HH11      ARG  90  -8.625  -2.002   8.985
  655   2HH1  ARG  90          HH12      ARG  90  -9.832  -2.854   8.061
  656   1HH2  ARG  90          HH21      ARG  90  -9.098  -1.221   5.045
  657   2HH2  ARG  90          HH22      ARG  90 -10.114  -2.393   5.826
  658    H    MET  91           HN       MET  91  -3.562   4.715   9.788
  659    HA   MET  91           HA       MET  91  -1.536   3.222  11.046
  660   1HB   MET  91          HB2       MET  91  -0.254   5.283  11.092
  661   2HB   MET  91          HB1       MET  91  -1.073   5.109   9.547
  662   1HG   MET  91          HG2       MET  91  -2.749   6.715  10.210
  663   2HG   MET  91          HG1       MET  91  -2.039   6.828  11.820
  664   1HE   MET  91          HE1       MET  91   1.063   6.774  11.179
  665   2HE   MET  91          HE2       MET  91   0.339   7.906  12.321
  666   3HE   MET  91          HE3       MET  91   1.423   8.496  11.061
  667    H    THR  92           HN       THR  92  -0.520   3.480  13.047
  668    HA   THR  92           HA       THR  92  -2.256   3.770  15.275
  669    HB   THR  92           HB       THR  92   0.772   3.723  15.286
  670    HG1  THR  92           HG1      THR  92   0.108   1.894  14.207
  671   1HG2  THR  92          HG21      THR  92  -1.249   2.909  17.380
  672   2HG2  THR  92          HG22      THR  92  -0.236   4.351  17.429
  673   3HG2  THR  92          HG23      THR  92   0.502   2.752  17.520
  674    HA   PRO  93           HA       PRO  93  -2.008   8.218  15.590
  675   1HB   PRO  93          HB2       PRO  93  -3.214   8.409  18.038
  676   2HB   PRO  93          HB1       PRO  93  -4.096   8.201  16.522
  677   1HG   PRO  93          HG2       PRO  93  -3.343   6.158  18.571
  678   2HG   PRO  93          HG1       PRO  93  -4.862   6.340  17.675
  679   1HD   PRO  93          HD2       PRO  93  -3.003   4.507  16.993
  680   2HD   PRO  93          HD1       PRO  93  -4.015   5.322  15.783
  681    H    HIS  94           HN       HIS  94  -0.602   9.632  16.472
  682    HA   HIS  94           HA       HIS  94   1.542   8.649  18.071
  683   1HB   HIS  94          HB2       HIS  94   0.792  11.422  17.147
  684   2HB   HIS  94          HB1       HIS  94   2.204  11.111  18.152
  685    HD1  HIS  94           HD1      HIS  94   1.462  11.671  14.773
  686    HD2  HIS  94           HD2      HIS  94   3.777   8.840  16.760
  687    HE1  HIS  94           HE1      HIS  94   3.080  10.789  13.060
  688    HE2  HIS  94           HE2      HIS  94   4.538   9.153  14.311
  689    H    ASN  95           HN       ASN  95   1.737   8.537  20.176
  690    HA   ASN  95           HA       ASN  95  -0.476   9.173  21.868
  691   1HB   ASN  95          HB2       ASN  95   0.985   7.188  22.184
  692   2HB   ASN  95          HB1       ASN  95   2.312   8.259  22.613
  693   1HD2  ASN  95          HD21      ASN  95   2.526   7.356  24.636
  694   2HD2  ASN  95          HD22      ASN  95   1.389   7.647  25.910
  695    H    GLY  96           HN       GLY  96   2.547  10.709  21.077
  696   1HA   GLY  96          HA2       GLY  96   1.727  13.161  22.270
  697   2HA   GLY  96          HA1       GLY  96   2.975  12.376  23.229
  698    HA   PRO  97           HA       PRO  97   5.031  14.849  19.822
  699   1HB   PRO  97          HB2       PRO  97   6.371  16.266  21.994
  700   2HB   PRO  97          HB1       PRO  97   5.420  16.921  20.660
  701   1HG   PRO  97          HG2       PRO  97   4.560  16.970  23.226
  702   2HG   PRO  97          HG1       PRO  97   3.455  16.845  21.846
  703   1HD   PRO  97          HD2       PRO  97   4.444  14.695  23.684
  704   2HD   PRO  97          HD1       PRO  97   2.813  14.954  23.026
  705    H    ILE  98           HN       ILE  98   6.551  13.508  19.087
  706    HA   ILE  98           HA       ILE  98   8.288  12.099  20.949
  707    HB   ILE  98           HB       ILE  98   8.066  11.817  17.949
  708   1HG1  ILE  98          HG12      ILE  98   6.824  10.149  20.148
  709   2HG1  ILE  98          HG11      ILE  98   5.957  11.280  19.114
  710   1HG2  ILE  98          HG21      ILE  98   9.185   9.653  18.317
  711   2HG2  ILE  98          HG22      ILE  98   9.378  10.065  20.021
  712   3HG2  ILE  98          HG23      ILE  98  10.191  11.023  18.785
  713   1HD1  ILE  98          HD11      ILE  98   5.629   9.008  18.365
  714   2HD1  ILE  98          HD12      ILE  98   7.372   8.781  18.221
  715   3HD1  ILE  98          HD13      ILE  98   6.540   9.922  17.163
  716    HA   PRO  99           HA       PRO  99  11.690  14.936  20.159
  717   1HB   PRO  99          HB2       PRO  99  13.280  12.828  21.460
  718   2HB   PRO  99          HB1       PRO  99  13.059  14.515  21.930
  719   1HG   PRO  99          HG2       PRO  99  11.954  12.494  23.319
  720   2HG   PRO  99          HG1       PRO  99  11.155  14.066  23.147
  721   1HD   PRO  99          HD2       PRO  99  10.612  11.495  21.718
  722   2HD   PRO  99          HD1       PRO  99   9.469  12.712  22.324
  723    H    ARG 100           HN       ARG 100  12.661  15.011  18.239
  724    HA   ARG 100           HA       ARG 100  13.399  12.476  16.942
  725   1HB   ARG 100          HB2       ARG 100  11.884  14.475  15.936
  726   2HB   ARG 100          HB1       ARG 100  13.473  15.014  15.412
  727   1HG   ARG 100          HG2       ARG 100  12.792  13.763  13.616
  728   2HG   ARG 100          HG1       ARG 100  13.709  12.570  14.542
  729   1HD   ARG 100          HD2       ARG 100  11.653  11.714  15.516
  730   2HD   ARG 100          HD1       ARG 100  10.717  12.943  14.668
  731    HE   ARG 100           HE       ARG 100  11.581  10.452  13.632
  732   1HH1  ARG 100          HH11      ARG 100  11.138  13.806  12.662
  733   2HH1  ARG 100          HH12      ARG 100  10.805  13.400  11.010
  734   1HH2  ARG 100          HH21      ARG 100  11.109   9.930  11.493
  735   2HH2  ARG 100          HH22      ARG 100  10.805  11.199  10.333
  736    H    TYR 101           HN       TYR 101  15.474  11.978  17.248
  737    HA   TYR 101           HA       TYR 101  17.394  14.029  17.899
  738   1HB   TYR 101          HB2       TYR 101  17.723  11.035  17.602
  739   2HB   TYR 101          HB1       TYR 101  18.958  12.136  18.206
  740    HD1  TYR 101           HD1      TYR 101  18.639  13.277  20.383
  741    HD2  TYR 101           HD2      TYR 101  15.920  10.311  19.000
  742    HE1  TYR 101           HE1      TYR 101  17.749  13.040  22.663
  743    HE2  TYR 101           HE2      TYR 101  15.022  10.066  21.275
  744    HH   TYR 101           HH       TYR 101  15.708  12.275  23.778
  745    H    VAL 102           HN       VAL 102  16.276  12.549  15.090
  746    HA   VAL 102           HA       VAL 102  18.570  13.630  13.625
  747    HB   VAL 102           HB       VAL 102  18.094  11.815  11.878
  748   1HG1  VAL 102          HG11      VAL 102  20.099  11.850  13.269
  749   2HG1  VAL 102          HG12      VAL 102  19.531  10.198  13.026
  750   3HG1  VAL 102          HG13      VAL 102  19.230  11.018  14.559
  751   1HG2  VAL 102          HG21      VAL 102  16.755  10.537  14.265
  752   2HG2  VAL 102          HG22      VAL 102  17.134   9.732  12.742
  753   3HG2  VAL 102          HG23      VAL 102  15.957  11.045  12.776
  Start of MODEL   13
    1   1H    MET   1          HT1       MET   1   6.990   0.469  -0.342
    2   2H    MET   1          HT2       MET   1   6.653   0.172  -1.978
    3   3H    MET   1          HT3       MET   1   7.600  -0.921  -1.096
    4    HA   MET   1           HA       MET   1   5.779  -1.541   0.268
    5   1HB   MET   1          HB2       MET   1   3.531  -0.657  -0.114
    6   2HB   MET   1          HB1       MET   1   4.639   0.633   0.328
    7   1HG   MET   1          HG2       MET   1   4.790   1.334  -1.985
    8   2HG   MET   1          HG1       MET   1   3.748  -0.001  -2.476
    9   1HE   MET   1          HE1       MET   1   2.185   1.730  -3.759
   10   2HE   MET   1          HE2       MET   1   3.218   3.064  -3.245
   11   3HE   MET   1          HE3       MET   1   1.474   3.154  -2.999
   12    H    THR   2           HN       THR   2   4.691  -3.373  -0.319
   13    HA   THR   2           HA       THR   2   4.682  -3.953  -3.209
   14    HB   THR   2           HB       THR   2   5.252  -5.959  -1.019
   15    HG1  THR   2           HG1      THR   2   7.105  -4.782  -2.847
   16   1HG2  THR   2          HG21      THR   2   5.567  -6.125  -4.019
   17   2HG2  THR   2          HG22      THR   2   4.306  -6.914  -3.072
   18   3HG2  THR   2          HG23      THR   2   5.992  -7.387  -2.862
   19    H    MET   3           HN       MET   3   3.542  -5.823  -0.414
   20    HA   MET   3           HA       MET   3   0.795  -5.634  -1.393
   21   1HB   MET   3          HB2       MET   3   2.333  -8.214  -1.050
   22   2HB   MET   3          HB1       MET   3   0.584  -8.135  -1.184
   23   1HG   MET   3          HG2       MET   3   0.777  -7.191  -3.411
   24   2HG   MET   3          HG1       MET   3   2.535  -7.202  -3.276
   25   1HE   MET   3          HE1       MET   3  -0.014 -11.049  -3.298
   26   2HE   MET   3          HE2       MET   3  -0.703  -9.426  -3.349
   27   3HE   MET   3          HE3       MET   3   0.129  -9.986  -1.898
   28    H    GLY   4           HN       GLY   4  -0.738  -6.711   0.128
   29   1HA   GLY   4          HA2       GLY   4  -0.054  -6.132   2.873
   30   2HA   GLY   4          HA1       GLY   4  -1.590  -6.757   2.284
   31    H    CYS   5           HN       CYS   5  -1.316  -8.104   4.300
   32    HA   CYS   5           HA       CYS   5  -0.369 -10.690   3.520
   33   1HB   CYS   5          HB2       CYS   5   1.752  -9.714   4.207
   34   2HB   CYS   5          HB1       CYS   5   1.056  -9.229   5.750
   35    H    ARG   6           HN       ARG   6  -1.226 -12.337   4.738
   36    HA   ARG   6           HA       ARG   6  -3.628 -11.940   6.058
   37   1HB   ARG   6          HB2       ARG   6  -3.388 -14.299   6.811
   38   2HB   ARG   6          HB1       ARG   6  -3.088 -14.069   5.094
   39   1HG   ARG   6          HG2       ARG   6  -0.658 -14.086   5.560
   40   2HG   ARG   6          HG1       ARG   6  -1.020 -14.441   7.250
   41   1HD   ARG   6          HD2       ARG   6  -0.450 -16.458   5.952
   42   2HD   ARG   6          HD1       ARG   6  -2.078 -16.519   6.626
   43    HE   ARG   6           HE       ARG   6  -2.920 -16.001   4.404
   44   1HH1  ARG   6          HH11      ARG   6   0.414 -17.042   4.623
   45   2HH1  ARG   6          HH12      ARG   6   0.471 -17.620   2.983
   46   1HH2  ARG   6          HH21      ARG   6  -2.854 -16.761   2.256
   47   2HH2  ARG   6          HH22      ARG   6  -1.380 -17.457   1.642
   48    H    HIS   7           HN       HIS   7  -0.402 -11.917   7.382
   49    HA   HIS   7           HA       HIS   7  -0.948 -12.236  10.092
   50   1HB   HIS   7          HB2       HIS   7   1.172 -10.663   8.650
   51   2HB   HIS   7          HB1       HIS   7   1.073 -10.660  10.406
   52    HD2  HIS   7           HD2      HIS   7   0.629 -13.793  10.993
   53    HE1  HIS   7           HE1      HIS   7   4.132 -14.298   8.673
   54    HE2  HIS   7           HE2      HIS   7   2.716 -15.271  10.543
   55    H    VAL   8           HN       VAL   8  -1.720  -9.618   7.986
   56    HA   VAL   8           HA       VAL   8  -1.898  -7.500   9.815
   57    HB   VAL   8           HB       VAL   8  -2.386  -7.835   7.088
   58   1HG1  VAL   8          HG11      VAL   8  -4.867  -6.708   8.370
   59   2HG1  VAL   8          HG12      VAL   8  -4.761  -8.291   7.597
   60   3HG1  VAL   8          HG13      VAL   8  -4.524  -6.825   6.643
   61   1HG2  VAL   8          HG21      VAL   8  -1.247  -5.963   8.146
   62   2HG2  VAL   8          HG22      VAL   8  -2.782  -5.387   8.797
   63   3HG2  VAL   8          HG23      VAL   8  -2.513  -5.403   7.055
   64    H    ALA   9           HN       ALA   9  -4.055 -10.186   9.189
   65    HA   ALA   9           HA       ALA   9  -6.324  -9.101  10.525
   66   1HB   ALA   9          HB1       ALA   9  -6.496 -10.944   8.922
   67   2HB   ALA   9          HB2       ALA   9  -7.199 -11.369  10.482
   68   3HB   ALA   9          HB3       ALA   9  -5.611 -11.989  10.032
   69    H    GLY  10           HN       GLY  10  -3.346 -10.118  11.676
   70   1HA   GLY  10          HA2       GLY  10  -4.396 -10.963  14.278
   71   2HA   GLY  10          HA1       GLY  10  -2.733 -11.122  13.733
   72    H    ILE  11           HN       ILE  11  -3.317  -8.147  12.760
   73    HA   ILE  11           HA       ILE  11  -2.361  -6.992  15.283
   74    HB   ILE  11           HB       ILE  11  -1.538  -5.103  13.980
   75   1HG1  ILE  11          HG12      ILE  11  -2.492  -6.627  11.547
   76   2HG1  ILE  11          HG11      ILE  11  -3.292  -5.207  12.210
   77   1HG2  ILE  11          HG21      ILE  11  -0.697  -7.786  12.894
   78   2HG2  ILE  11          HG22      ILE  11  -0.058  -6.982  14.328
   79   3HG2  ILE  11          HG23      ILE  11   0.223  -6.291  12.730
   80   1HD1  ILE  11          HD11      ILE  11  -1.949  -4.628  10.293
   81   2HD1  ILE  11          HD12      ILE  11  -0.516  -5.309  11.063
   82   3HD1  ILE  11          HD13      ILE  11  -1.290  -3.881  11.749
   83    H    ARG  12           HN       ARG  12  -3.220  -5.066  16.089
   84    HA   ARG  12           HA       ARG  12  -5.771  -4.184  14.929
   85   1HB   ARG  12          HB2       ARG  12  -6.722  -4.028  17.215
   86   2HB   ARG  12          HB1       ARG  12  -6.362  -5.680  16.736
   87   1HG   ARG  12          HG2       ARG  12  -4.277  -5.579  18.039
   88   2HG   ARG  12          HG1       ARG  12  -4.706  -3.949  18.561
   89   1HD   ARG  12          HD2       ARG  12  -5.294  -5.585  20.264
   90   2HD   ARG  12          HD1       ARG  12  -6.740  -4.820  19.605
   91    HE   ARG  12           HE       ARG  12  -6.928  -6.897  18.187
   92   1HH1  ARG  12          HH11      ARG  12  -5.417  -6.901  21.349
   93   2HH1  ARG  12          HH12      ARG  12  -5.692  -8.601  21.618
   94   1HH2  ARG  12          HH21      ARG  12  -7.320  -9.122  18.550
   95   2HH2  ARG  12          HH22      ARG  12  -6.798  -9.851  20.043
   96    H    THR  13           HN       THR  13  -6.486  -2.107  16.286
   97    HA   THR  13           HA       THR  13  -4.286  -0.243  16.181
   98    HB   THR  13           HB       THR  13  -7.102   0.248  17.176
   99    HG1  THR  13           HG1      THR  13  -7.537   0.902  15.045
  100   1HG2  THR  13          HG21      THR  13  -5.498   1.979  17.815
  101   2HG2  THR  13          HG22      THR  13  -6.615   2.586  16.592
  102   3HG2  THR  13          HG23      THR  13  -4.974   2.127  16.138
  103    H    VAL  14           HN       VAL  14  -2.859  -0.317  17.774
  104    HA   VAL  14           HA       VAL  14  -3.729  -1.209  20.419
  105    HB   VAL  14           HB       VAL  14  -1.277  -1.555  20.823
  106   1HG1  VAL  14          HG11      VAL  14  -2.707  -3.403  20.175
  107   2HG1  VAL  14          HG12      VAL  14  -1.126  -3.564  19.409
  108   3HG1  VAL  14          HG13      VAL  14  -2.507  -2.991  18.472
  109   1HG2  VAL  14          HG21      VAL  14  -0.415   0.041  19.188
  110   2HG2  VAL  14          HG22      VAL  14  -1.086  -0.926  17.874
  111   3HG2  VAL  14          HG23      VAL  14   0.214  -1.577  18.872
  112    H    THR  15           HN       THR  15  -2.380  -0.319  22.262
  113    HA   THR  15           HA       THR  15  -2.293   2.609  22.068
  114    HB   THR  15           HB       THR  15  -2.306   0.875  24.553
  115    HG1  THR  15           HG1      THR  15  -4.509   2.449  23.794
  116   1HG2  THR  15          HG21      THR  15  -1.316   3.080  24.908
  117   2HG2  THR  15          HG22      THR  15  -2.882   2.965  25.710
  118   3HG2  THR  15          HG23      THR  15  -2.733   3.844  24.188
  119    HA   PRO  16           HA       PRO  16   2.159   2.239  21.965
  120   1HB   PRO  16          HB2       PRO  16   2.038   5.081  22.786
  121   2HB   PRO  16          HB1       PRO  16   2.821   4.347  21.383
  122   1HG   PRO  16          HG2       PRO  16   0.579   5.770  21.115
  123   2HG   PRO  16          HG1       PRO  16   0.865   4.315  20.141
  124   1HD   PRO  16          HD2       PRO  16  -0.862   4.671  22.559
  125   2HD   PRO  16          HD1       PRO  16  -1.177   3.747  21.075
  126    H    SER  17           HN       SER  17   3.034   1.182  23.607
  127    HA   SER  17           HA       SER  17   2.612   1.537  26.330
  128   1HB   SER  17          HB2       SER  17   3.633  -0.473  25.399
  129   2HB   SER  17          HB1       SER  17   5.038   0.450  24.875
  130    HG   SER  17           HG       SER  17   4.204  -0.010  27.557
  131    H    ALA  18           HN       ALA  18   4.987   3.025  24.196
  132    HA   ALA  18           HA       ALA  18   5.600   4.963  26.305
  133   1HB   ALA  18          HB1       ALA  18   7.967   4.914  25.717
  134   2HB   ALA  18          HB2       ALA  18   7.660   3.652  24.525
  135   3HB   ALA  18          HB3       ALA  18   7.428   3.318  26.241
  136    H    LEU  19           HN       LEU  19   6.705   6.926  25.352
  137    HA   LEU  19           HA       LEU  19   5.224   7.803  23.035
  138   1HB   LEU  19          HB2       LEU  19   7.454   9.237  24.487
  139   2HB   LEU  19          HB1       LEU  19   6.272   9.953  23.409
  140    HG   LEU  19           HG       LEU  19   5.730   8.794  26.143
  141   1HD1  LEU  19          HD11      LEU  19   6.836  10.946  26.226
  142   2HD1  LEU  19          HD12      LEU  19   5.148  11.111  26.711
  143   3HD1  LEU  19          HD13      LEU  19   5.658  11.621  25.101
  144   1HD2  LEU  19          HD21      LEU  19   3.438   9.619  25.817
  145   2HD2  LEU  19          HD22      LEU  19   3.857   8.345  24.672
  146   3HD2  LEU  19          HD23      LEU  19   3.835  10.029  24.148
  147    H    GLY  20           HN       GLY  20   8.527   7.006  23.856
  148   1HA   GLY  20          HA2       GLY  20   9.119   6.776  20.981
  149   2HA   GLY  20          HA1       GLY  20  10.301   7.417  22.119
  150    H    CYS  21           HN       CYS  21  11.793   5.737  21.642
  151    HA   CYS  21           HA       CYS  21  10.999   3.019  22.183
  152   1HB   CYS  21          HB2       CYS  21  13.472   2.555  21.874
  153   2HB   CYS  21          HB1       CYS  21  12.637   3.228  20.483
  154    HG   CYS  21           HG       CYS  21  13.835   5.584  20.426
  155    H    GLU  22           HN       GLU  22  10.524   2.591  24.200
  156    HA   GLU  22           HA       GLU  22  11.415   3.855  26.494
  157   1HB   GLU  22          HB2       GLU  22  10.487   1.995  27.723
  158   2HB   GLU  22          HB1       GLU  22   9.443   2.368  26.362
  159   1HG   GLU  22          HG2       GLU  22  11.391   0.079  26.557
  160   2HG   GLU  22          HG1       GLU  22   9.635  -0.017  26.649
  161    H    GLU  23           HN       GLU  23  12.854   1.209  24.717
  162    HA   GLU  23           HA       GLU  23  14.778   0.341  26.520
  163   1HB   GLU  23          HB2       GLU  23  14.283  -0.684  24.310
  164   2HB   GLU  23          HB1       GLU  23  15.094   0.666  23.530
  165   1HG   GLU  23          HG2       GLU  23  16.516  -1.304  23.647
  166   2HG   GLU  23          HG1       GLU  23  17.190   0.041  24.566
  167    H    CYS  24           HN       CYS  24  15.189   2.837  23.997
  168    HA   CYS  24           HA       CYS  24  17.736   3.626  24.978
  169   1HB   CYS  24          HB2       CYS  24  15.819   4.992  23.083
  170   2HB   CYS  24          HB1       CYS  24  17.465   5.528  23.383
  171    HG   CYS  24           HG       CYS  24  18.454   4.137  21.479
  172    H    LEU  25           HN       LEU  25  14.452   4.637  25.589
  173    HA   LEU  25           HA       LEU  25  15.082   7.111  26.840
  174   1HB   LEU  25          HB2       LEU  25  12.632   5.374  26.831
  175   2HB   LEU  25          HB1       LEU  25  12.715   6.853  27.771
  176    HG   LEU  25           HG       LEU  25  13.061   6.696  24.774
  177   1HD1  LEU  25          HD11      LEU  25  10.716   7.622  26.429
  178   2HD1  LEU  25          HD12      LEU  25  10.778   6.161  25.443
  179   3HD1  LEU  25          HD13      LEU  25  10.855   7.747  24.676
  180   1HD2  LEU  25          HD21      LEU  25  12.801   9.061  26.632
  181   2HD2  LEU  25          HD22      LEU  25  12.906   9.129  24.872
  182   3HD2  LEU  25          HD23      LEU  25  14.278   8.547  25.815
  183    H    LYS  26           HN       LYS  26  15.361   3.876  27.949
  184    HA   LYS  26           HA       LYS  26  14.830   4.472  30.712
  185   1HB   LYS  26          HB2       LYS  26  15.409   2.241  31.190
  186   2HB   LYS  26          HB1       LYS  26  14.641   2.179  29.611
  187   1HG   LYS  26          HG2       LYS  26  16.982   2.240  28.633
  188   2HG   LYS  26          HG1       LYS  26  17.557   1.932  30.273
  189   1HD   LYS  26          HD2       LYS  26  15.655   0.194  28.705
  190   2HD   LYS  26          HD1       LYS  26  17.363  -0.139  28.995
  191   1HE   LYS  26          HE2       LYS  26  16.959  -0.296  31.378
  192   2HE   LYS  26          HE1       LYS  26  15.268   0.145  31.146
  193   1HZ   LYS  26          HZ1       LYS  26  16.528  -2.275  29.977
  194   2HZ   LYS  26          HZ2       LYS  26  14.880  -1.880  29.971
  195   3HZ   LYS  26          HZ3       LYS  26  15.655  -2.266  31.430
  196    H    ILE  27           HN       ILE  27  17.467   4.901  28.606
  197    HA   ILE  27           HA       ILE  27  19.213   5.476  30.908
  198    HB   ILE  27           HB       ILE  27  21.148   4.979  29.419
  199   1HG1  ILE  27          HG12      ILE  27  18.977   3.921  27.596
  200   2HG1  ILE  27          HG11      ILE  27  20.099   5.231  27.249
  201   1HG2  ILE  27          HG21      ILE  27  20.389   3.358  31.058
  202   2HG2  ILE  27          HG22      ILE  27  20.957   2.541  29.602
  203   3HG2  ILE  27          HG23      ILE  27  19.227   2.707  29.902
  204   1HD1  ILE  27          HD11      ILE  27  20.767   3.232  26.094
  205   2HD1  ILE  27          HD12      ILE  27  20.796   2.328  27.607
  206   3HD1  ILE  27          HD13      ILE  27  21.956   3.628  27.333
  207    H    GLY  28           HN       GLY  28  17.484   6.812  28.442
  208   1HA   GLY  28          HA2       GLY  28  17.345   9.052  27.862
  209   2HA   GLY  28          HA1       GLY  28  18.827   9.345  28.757
  210    H    SER  29           HN       SER  29  18.681   6.864  26.318
  211    HA   SER  29           HA       SER  29  20.653   8.349  24.767
  212   1HB   SER  29          HB2       SER  29  19.695   5.483  24.614
  213   2HB   SER  29          HB1       SER  29  20.886   6.179  23.519
  214    HG   SER  29           HG       SER  29  21.452   6.623  26.168
  215    HA   PRO  30           HA       PRO  30  17.740   9.553  21.680
  216   1HB   PRO  30          HB2       PRO  30  19.384   9.921  19.570
  217   2HB   PRO  30          HB1       PRO  30  19.378  11.006  20.966
  218   1HG   PRO  30          HG2       PRO  30  21.252   8.764  20.318
  219   2HG   PRO  30          HG1       PRO  30  21.619  10.383  20.943
  220   1HD   PRO  30          HD2       PRO  30  21.503   8.173  22.524
  221   2HD   PRO  30          HD1       PRO  30  21.101   9.801  23.104
  222    H    TRP  31           HN       TRP  31  17.191   9.064  19.306
  223    HA   TRP  31           HA       TRP  31  17.765   6.309  18.554
  224   1HB   TRP  31          HB2       TRP  31  15.369   5.834  18.171
  225   2HB   TRP  31          HB1       TRP  31  15.726   6.118  19.869
  226    HD1  TRP  31           HD1      TRP  31  14.204   8.019  16.846
  227    HE1  TRP  31           HE1      TRP  31  12.455   9.674  17.751
  228    HE3  TRP  31           HE3      TRP  31  14.891   7.274  21.856
  229    HZ2  TRP  31           HZ2      TRP  31  11.487  10.540  20.250
  230    HZ3  TRP  31           HZ3      TRP  31  13.508   8.553  23.435
  231    HH2  TRP  31           HH2      TRP  31  11.841  10.153  22.649
  232    H    VAL  32           HN       VAL  32  16.963   5.829  16.350
  233    HA   VAL  32           HA       VAL  32  17.158   8.209  14.650
  234    HB   VAL  32           HB       VAL  32  17.375   5.310  13.815
  235   1HG1  VAL  32          HG11      VAL  32  16.746   6.805  12.006
  236   2HG1  VAL  32          HG12      VAL  32  18.401   6.237  11.784
  237   3HG1  VAL  32          HG13      VAL  32  18.101   7.867  12.386
  238   1HG2  VAL  32          HG21      VAL  32  19.176   5.825  15.354
  239   2HG2  VAL  32          HG22      VAL  32  19.570   7.284  14.445
  240   3HG2  VAL  32          HG23      VAL  32  19.807   5.698  13.711
  241    H    HIS  33           HN       HIS  33  15.375   5.125  14.786
  242    HA   HIS  33           HA       HIS  33  12.970   6.543  13.909
  243   1HB   HIS  33          HB2       HIS  33  14.059   4.005  12.680
  244   2HB   HIS  33          HB1       HIS  33  12.396   4.538  12.470
  245    HD1  HIS  33           HD1      HIS  33  15.388   4.524  10.669
  246    HD2  HIS  33           HD2      HIS  33  12.562   7.478  11.469
  247    HE1  HIS  33           HE1      HIS  33  15.693   6.269   8.879
  248    HE2  HIS  33           HE2      HIS  33  14.108   8.130   9.499
  249    H    LEU  34           HN       LEU  34  10.989   5.400  14.385
  250    HA   LEU  34           HA       LEU  34  11.278   3.589  16.707
  251   1HB   LEU  34          HB2       LEU  34   9.238   5.779  16.302
  252   2HB   LEU  34          HB1       LEU  34   9.266   4.658  17.649
  253    HG   LEU  34           HG       LEU  34  11.409   6.694  17.040
  254   1HD1  LEU  34          HD11      LEU  34  10.566   7.827  19.045
  255   2HD1  LEU  34          HD12      LEU  34   9.255   6.652  19.148
  256   3HD1  LEU  34          HD13      LEU  34   9.349   7.749  17.771
  257   1HD2  LEU  34          HD21      LEU  34  11.045   4.854  19.402
  258   2HD2  LEU  34          HD22      LEU  34  12.304   6.076  19.218
  259   3HD2  LEU  34          HD23      LEU  34  12.264   4.680  18.140
  260    H    ARG  35           HN       ARG  35   9.952   1.847  16.794
  261    HA   ARG  35           HA       ARG  35   7.899   1.594  14.694
  262   1HB   ARG  35          HB2       ARG  35   9.761  -0.552  15.730
  263   2HB   ARG  35          HB1       ARG  35   8.410  -0.842  14.647
  264   1HG   ARG  35          HG2       ARG  35   9.462   0.524  12.935
  265   2HG   ARG  35          HG1       ARG  35  10.805   0.875  14.026
  266   1HD   ARG  35          HD2       ARG  35  11.401  -1.472  14.095
  267   2HD   ARG  35          HD1       ARG  35  10.008  -1.880  13.096
  268    HE   ARG  35           HE       ARG  35  11.545  -0.034  11.685
  269   1HH1  ARG  35          HH11      ARG  35  11.776  -3.339  12.833
  270   2HH1  ARG  35          HH12      ARG  35  12.908  -3.808  11.606
  271   1HH2  ARG  35          HH21      ARG  35  13.011  -0.669  10.061
  272   2HH2  ARG  35          HH22      ARG  35  13.627  -2.296  10.050
  273    H    ILE  36           HN       ILE  36   5.935   1.411  15.545
  274    HA   ILE  36           HA       ILE  36   5.647   0.338  18.269
  275    HB   ILE  36           HB       ILE  36   4.493   2.440  17.905
  276   1HG1  ILE  36          HG12      ILE  36   2.535   0.133  18.030
  277   2HG1  ILE  36          HG11      ILE  36   3.446   0.779  19.391
  278   1HG2  ILE  36          HG21      ILE  36   2.668   2.674  16.298
  279   2HG2  ILE  36          HG22      ILE  36   2.996   1.052  15.690
  280   3HG2  ILE  36          HG23      ILE  36   4.198   2.327  15.493
  281   1HD1  ILE  36          HD11      ILE  36   1.145   1.567  19.389
  282   2HD1  ILE  36          HD12      ILE  36   1.382   2.277  17.792
  283   3HD1  ILE  36          HD13      ILE  36   2.278   2.901  19.177
  284    H    CYS  37           HN       CYS  37   5.143  -1.634  18.569
  285    HA   CYS  37           HA       CYS  37   4.645  -3.434  16.417
  286   1HB   CYS  37          HB2       CYS  37   5.959  -3.982  18.422
  287   2HB   CYS  37          HB1       CYS  37   4.516  -3.804  19.408
  288    H    ARG  38           HN       ARG  38   2.720  -3.746  15.483
  289    HA   ARG  38           HA       ARG  38   0.381  -2.490  16.529
  290   1HB   ARG  38          HB2       ARG  38   0.845  -4.224  14.109
  291   2HB   ARG  38          HB1       ARG  38  -0.712  -3.506  14.492
  292   1HG   ARG  38          HG2       ARG  38   1.826  -1.956  14.033
  293   2HG   ARG  38          HG1       ARG  38   0.576  -2.235  12.820
  294   1HD   ARG  38          HD2       ARG  38   0.262  -0.748  15.427
  295   2HD   ARG  38          HD1       ARG  38   0.299  -0.045  13.810
  296    HE   ARG  38           HE       ARG  38  -1.820  -1.945  14.562
  297   1HH1  ARG  38          HH11      ARG  38  -0.813   1.234  13.479
  298   2HH1  ARG  38          HH12      ARG  38  -2.436   1.751  13.118
  299   1HH2  ARG  38          HH21      ARG  38  -3.953  -1.249  14.070
  300   2HH2  ARG  38          HH22      ARG  38  -4.205   0.353  13.458
  301    H    THR  39           HN       THR  39   1.651  -5.311  17.529
  302    HA   THR  39           HA       THR  39  -0.926  -6.698  17.683
  303    HB   THR  39           HB       THR  39   1.673  -7.819  18.696
  304    HG1  THR  39           HG1      THR  39   1.238  -8.817  16.306
  305   1HG2  THR  39          HG21      THR  39   0.585  -9.952  18.149
  306   2HG2  THR  39          HG22      THR  39  -0.836  -9.077  17.578
  307   3HG2  THR  39          HG23      THR  39  -0.381  -9.005  19.281
  308    H    CYS  40           HN       CYS  40   1.761  -5.761  19.825
  309    HA   CYS  40           HA       CYS  40  -0.054  -6.130  22.105
  310   1HB   CYS  40          HB2       CYS  40   1.935  -6.525  23.464
  311   2HB   CYS  40          HB1       CYS  40   1.943  -7.584  22.060
  312    H    GLY  41           HN       GLY  41   1.343  -3.737  20.249
  313   1HA   GLY  41          HA2       GLY  41   1.166  -1.452  20.494
  314   2HA   GLY  41          HA1       GLY  41   0.489  -1.715  22.091
  315    H    HIS  42           HN       HIS  42   3.541  -3.194  21.459
  316    HA   HIS  42           HA       HIS  42   4.721  -1.303  23.351
  317   1HB   HIS  42          HB2       HIS  42   4.825  -3.908  23.585
  318   2HB   HIS  42          HB1       HIS  42   6.116  -3.787  22.393
  319    HD1  HIS  42           HD1      HIS  42   5.264  -2.868  25.938
  320    HD2  HIS  42           HD2      HIS  42   8.538  -2.775  23.365
  321    HE1  HIS  42           HE1      HIS  42   7.252  -2.345  27.384
  322    HE2  HIS  42           HE2      HIS  42   9.238  -2.469  25.842
  323    H    VAL  43           HN       VAL  43   6.459  -0.052  22.847
  324    HA   VAL  43           HA       VAL  43   6.880   0.344  19.999
  325    HB   VAL  43           HB       VAL  43   8.062   2.011  22.222
  326   1HG1  VAL  43          HG11      VAL  43   8.944   2.520  20.048
  327   2HG1  VAL  43          HG12      VAL  43   7.856   3.821  20.529
  328   3HG1  VAL  43          HG13      VAL  43   7.322   2.612  19.361
  329   1HG2  VAL  43          HG21      VAL  43   5.299   2.250  21.037
  330   2HG2  VAL  43          HG22      VAL  43   6.066   3.462  22.064
  331   3HG2  VAL  43          HG23      VAL  43   5.703   1.861  22.709
  332    H    GLY  44           HN       GLY  44   9.190   0.875  19.329
  333   1HA   GLY  44          HA2       GLY  44  11.354  -0.097  20.913
  334   2HA   GLY  44          HA1       GLY  44  10.932  -1.218  19.624
  335    H    CYS  45           HN       CYS  45  13.362   0.413  20.017
  336    HA   CYS  45           HA       CYS  45  13.289   2.419  17.976
  337   1HB   CYS  45          HB2       CYS  45  15.822   2.335  18.281
  338   2HB   CYS  45          HB1       CYS  45  14.870   2.806  19.685
  339    HG   CYS  45           HG       CYS  45  16.670   1.286  20.897
  340    H    CYS  46           HN       CYS  46  13.936   2.300  15.910
  341    HA   CYS  46           HA       CYS  46  13.706  -0.149  14.551
  342   1HB   CYS  46          HB2       CYS  46  13.178   2.036  13.558
  343   2HB   CYS  46          HB1       CYS  46  14.877   2.483  13.622
  344    HG   CYS  46           HG       CYS  46  15.232   1.797  11.183
  345    H    ASP  47           HN       ASP  47  15.410  -0.952  12.976
  346    HA   ASP  47           HA       ASP  47  17.672  -1.806  14.440
  347   1HB   ASP  47          HB2       ASP  47  18.411  -2.825  12.282
  348   2HB   ASP  47          HB1       ASP  47  16.775  -3.261  12.755
  349    H    ASP  48           HN       ASP  48  17.099   1.056  12.768
  350    HA   ASP  48           HA       ASP  48  19.720   1.730  11.939
  351   1HB   ASP  48          HB2       ASP  48  17.495   3.555  12.887
  352   2HB   ASP  48          HB1       ASP  48  18.943   4.074  12.036
  353    H    SER  49           HN       SER  49  18.179   1.557  15.009
  354    HA   SER  49           HA       SER  49  20.246   3.142  16.334
  355   1HB   SER  49          HB2       SER  49  17.871   3.497  16.965
  356   2HB   SER  49          HB1       SER  49  17.763   1.809  17.456
  357    HG   SER  49           HG       SER  49  19.305   3.879  18.621
  358    HA   PRO  50           HA       PRO  50  22.827  -0.293  17.272
  359   1HB   PRO  50          HB2       PRO  50  23.465   0.414  19.906
  360   2HB   PRO  50          HB1       PRO  50  24.326   0.921  18.451
  361   1HG   PRO  50          HG2       PRO  50  22.259   2.371  20.035
  362   2HG   PRO  50          HG1       PRO  50  23.688   3.008  19.200
  363   1HD   PRO  50          HD2       PRO  50  21.236   3.310  18.180
  364   2HD   PRO  50          HD1       PRO  50  22.631   2.991  17.128
  365    H    HIS  51           HN       HIS  51  20.301   0.556  19.586
  366    HA   HIS  51           HA       HIS  51  20.423  -1.854  21.079
  367   1HB   HIS  51          HB2       HIS  51  18.442   0.361  20.824
  368   2HB   HIS  51          HB1       HIS  51  17.929  -1.139  21.584
  369    HD1  HIS  51           HD1      HIS  51  18.918   2.003  22.592
  370    HD2  HIS  51           HD2      HIS  51  20.243  -1.802  23.627
  371    HE1  HIS  51           HE1      HIS  51  19.911   2.230  24.886
  372    HE2  HIS  51           HE2      HIS  51  20.667  -0.084  25.522
  373    H    LYS  52           HN       LYS  52  18.469  -0.847  18.302
  374    HA   LYS  52           HA       LYS  52  17.029  -1.953  16.926
  375   1HB   LYS  52          HB2       LYS  52  18.738  -4.353  17.617
  376   2HB   LYS  52          HB1       LYS  52  17.686  -4.195  16.220
  377   1HG   LYS  52          HG2       LYS  52  19.085  -2.353  15.394
  378   2HG   LYS  52          HG1       LYS  52  20.157  -2.568  16.778
  379   1HD   LYS  52          HD2       LYS  52  19.570  -4.632  14.655
  380   2HD   LYS  52          HD1       LYS  52  21.044  -3.670  14.785
  381   1HE   LYS  52          HE2       LYS  52  21.496  -4.683  16.975
  382   2HE   LYS  52          HE1       LYS  52  20.036  -5.659  16.818
  383   1HZ   LYS  52          HZ1       LYS  52  21.979  -6.932  16.196
  384   2HZ   LYS  52          HZ2       LYS  52  22.415  -5.770  15.043
  385   3HZ   LYS  52          HZ3       LYS  52  21.001  -6.682  14.833
  386    H    HIS  53           HN       HIS  53  15.963  -1.636  19.445
  387    HA   HIS  53           HA       HIS  53  15.211  -4.082  20.680
  388   1HB   HIS  53          HB2       HIS  53  15.296  -1.784  21.784
  389   2HB   HIS  53          HB1       HIS  53  13.747  -1.463  21.011
  390    HD1  HIS  53           HD1      HIS  53  12.310  -1.407  23.144
  391    HD2  HIS  53           HD2      HIS  53  14.582  -4.882  22.763
  392    HE1  HIS  53           HE1      HIS  53  11.498  -2.959  24.944
  393    HE2  HIS  53           HE2      HIS  53  12.998  -4.979  24.802
  394    H    ALA  54           HN       ALA  54  13.901  -2.291  18.032
  395    HA   ALA  54           HA       ALA  54  11.237  -3.326  18.222
  396   1HB   ALA  54          HB1       ALA  54  11.753  -1.207  17.083
  397   2HB   ALA  54          HB2       ALA  54  10.879  -2.336  16.048
  398   3HB   ALA  54          HB3       ALA  54  12.615  -2.108  15.835
  399    H    THR  55           HN       THR  55  14.161  -4.271  16.478
  400    HA   THR  55           HA       THR  55  12.799  -6.309  14.970
  401    HB   THR  55           HB       THR  55  15.175  -6.989  14.355
  402    HG1  THR  55           HG1      THR  55  16.795  -5.487  14.900
  403   1HG2  THR  55          HG21      THR  55  13.818  -5.569  12.908
  404   2HG2  THR  55          HG22      THR  55  15.503  -5.048  12.886
  405   3HG2  THR  55          HG23      THR  55  14.313  -4.145  13.822
  406    H    ARG  56           HN       ARG  56  15.008  -6.196  17.731
  407    HA   ARG  56           HA       ARG  56  15.224  -8.956  18.177
  408   1HB   ARG  56          HB2       ARG  56  15.396  -6.627  20.088
  409   2HB   ARG  56          HB1       ARG  56  15.775  -8.282  20.542
  410   1HG   ARG  56          HG2       ARG  56  17.563  -8.340  18.893
  411   2HG   ARG  56          HG1       ARG  56  17.170  -6.692  18.397
  412   1HD   ARG  56          HD2       ARG  56  19.098  -6.827  19.951
  413   2HD   ARG  56          HD1       ARG  56  17.771  -5.839  20.561
  414    HE   ARG  56           HE       ARG  56  17.156  -7.729  21.988
  415   1HH1  ARG  56          HH11      ARG  56  20.374  -7.701  20.609
  416   2HH1  ARG  56          HH12      ARG  56  21.054  -8.712  21.847
  417   1HH2  ARG  56          HH21      ARG  56  18.037  -9.076  23.606
  418   2HH2  ARG  56          HH22      ARG  56  19.717  -9.516  23.541
  419    H    HIS  57           HN       HIS  57  12.795  -6.623  19.144
  420    HA   HIS  57           HA       HIS  57  11.392  -8.103  21.030
  421   1HB   HIS  57          HB2       HIS  57  10.892  -5.765  20.654
  422   2HB   HIS  57          HB1       HIS  57  10.379  -6.099  19.004
  423    HD1  HIS  57           HD1      HIS  57   9.258  -6.573  22.585
  424    HD2  HIS  57           HD2      HIS  57   7.801  -6.968  18.706
  425    HE1  HIS  57           HE1      HIS  57   6.772  -6.998  22.790
  426    H    PHE  58           HN       PHE  58  11.145  -8.116  17.504
  427    HA   PHE  58           HA       PHE  58   8.881  -9.770  17.313
  428   1HB   PHE  58          HB2       PHE  58   9.472  -8.596  15.357
  429   2HB   PHE  58          HB1       PHE  58  11.139  -9.160  15.419
  430    HD1  PHE  58           HD1      PHE  58   7.721 -10.670  15.265
  431    HD2  PHE  58           HD2      PHE  58  11.722 -10.698  13.859
  432    HE1  PHE  58           HE1      PHE  58   7.168 -12.520  13.744
  433    HE2  PHE  58           HE2      PHE  58  11.181 -12.542  12.327
  434    HZ   PHE  58           HZ       PHE  58   8.900 -13.459  12.272
  435    H    HIS  59           HN       HIS  59  12.322 -10.504  17.511
  436    HA   HIS  59           HA       HIS  59  12.104 -13.250  16.888
  437   1HB   HIS  59          HB2       HIS  59  14.215 -11.861  16.850
  438   2HB   HIS  59          HB1       HIS  59  14.237 -11.969  18.606
  439    HD1  HIS  59           HD1      HIS  59  15.451 -13.918  19.560
  440    HD2  HIS  59           HD2      HIS  59  14.366 -14.519  15.587
  441    HE1  HIS  59           HE1      HIS  59  16.500 -16.109  18.886
  442    HE2  HIS  59           HE2      HIS  59  15.697 -16.524  16.530
  443    H    ALA  60           HN       ALA  60  11.550 -11.446  19.787
  444    HA   ALA  60           HA       ALA  60  11.666 -13.798  21.490
  445   1HB   ALA  60          HB1       ALA  60  12.584 -11.660  22.272
  446   2HB   ALA  60          HB2       ALA  60  11.300 -12.258  23.324
  447   3HB   ALA  60          HB3       ALA  60  10.972 -10.949  22.188
  448    H    THR  61           HN       THR  61   9.212 -11.475  20.360
  449    HA   THR  61           HA       THR  61   7.165 -12.931  21.850
  450    HB   THR  61           HB       THR  61   5.652 -11.071  21.035
  451    HG1  THR  61           HG1      THR  61   8.146  -9.889  20.299
  452   1HG2  THR  61          HG21      THR  61   6.494  -9.453  22.651
  453   2HG2  THR  61          HG22      THR  61   8.064 -10.262  22.663
  454   3HG2  THR  61          HG23      THR  61   6.639 -11.094  23.285
  455    H    GLY  62           HN       GLY  62   8.300 -12.606  18.604
  456   1HA   GLY  62          HA2       GLY  62   7.604 -13.690  16.688
  457   2HA   GLY  62          HA1       GLY  62   6.365 -14.494  17.642
  458    H    HIS  63           HN       HIS  63   6.787 -11.017  17.444
  459    HA   HIS  63           HA       HIS  63   4.108 -10.825  16.243
  460   1HB   HIS  63          HB2       HIS  63   5.708  -8.837  17.873
  461   2HB   HIS  63          HB1       HIS  63   4.216  -8.421  17.041
  462    HD2  HIS  63           HD2      HIS  63   2.932 -11.493  18.107
  463    HE1  HIS  63           HE1      HIS  63   2.936  -9.270  21.713
  464    HE2  HIS  63           HE2      HIS  63   1.820 -11.160  20.435
  465    HA   PRO  64           HA       PRO  64   6.870  -9.977  12.829
  466   1HB   PRO  64          HB2       PRO  64   5.309 -10.865  10.864
  467   2HB   PRO  64          HB1       PRO  64   6.011 -11.970  12.051
  468   1HG   PRO  64          HG2       PRO  64   3.234 -10.871  11.895
  469   2HG   PRO  64          HG1       PRO  64   3.769 -12.512  12.302
  470   1HD   PRO  64          HD2       PRO  64   3.066 -10.566  14.144
  471   2HD   PRO  64          HD1       PRO  64   4.077 -11.981  14.495
  472    H    ILE  65           HN       ILE  65   4.390  -7.997  13.684
  473    HA   ILE  65           HA       ILE  65   4.801  -6.397  11.257
  474    HB   ILE  65           HB       ILE  65   2.136  -6.753  12.629
  475   1HG1  ILE  65          HG12      ILE  65   3.130  -7.462   9.860
  476   2HG1  ILE  65          HG11      ILE  65   2.661  -8.587  11.129
  477   1HG2  ILE  65          HG21      ILE  65   2.427  -4.433  12.006
  478   2HG2  ILE  65          HG22      ILE  65   1.280  -5.200  10.909
  479   3HG2  ILE  65          HG23      ILE  65   2.936  -4.901  10.384
  480   1HD1  ILE  65          HD11      ILE  65   0.359  -7.807  10.974
  481   2HD1  ILE  65          HD12      ILE  65   0.946  -8.404   9.421
  482   3HD1  ILE  65          HD13      ILE  65   0.828  -6.668   9.713
  483    H    ILE  66           HN       ILE  66   5.487  -4.463  11.595
  484    HA   ILE  66           HA       ILE  66   4.877  -3.114  14.136
  485    HB   ILE  66           HB       ILE  66   7.108  -1.947  13.863
  486   1HG1  ILE  66          HG12      ILE  66   8.755  -3.642  12.629
  487   2HG1  ILE  66          HG11      ILE  66   7.307  -3.988  11.695
  488   1HG2  ILE  66          HG21      ILE  66   6.740  -3.622  15.564
  489   2HG2  ILE  66          HG22      ILE  66   8.367  -3.777  14.902
  490   3HG2  ILE  66          HG23      ILE  66   7.104  -4.906  14.411
  491   1HD1  ILE  66          HD11      ILE  66   7.139  -1.676  11.032
  492   2HD1  ILE  66          HD12      ILE  66   8.737  -2.311  10.637
  493   3HD1  ILE  66          HD13      ILE  66   8.526  -1.262  12.039
  494    H    GLU  67           HN       GLU  67   4.728  -0.821  14.003
  495    HA   GLU  67           HA       GLU  67   4.247   0.179  11.275
  496   1HB   GLU  67          HB2       GLU  67   2.157   0.034  12.444
  497   2HB   GLU  67          HB1       GLU  67   2.833   0.802  13.870
  498   1HG   GLU  67          HG2       GLU  67   2.990   2.906  12.735
  499   2HG   GLU  67          HG1       GLU  67   2.508   2.165  11.209
  500    H    GLY  68           HN       GLY  68   5.109   2.137  10.713
  501   1HA   GLY  68          HA2       GLY  68   7.352   3.101  12.177
  502   2HA   GLY  68          HA1       GLY  68   6.624   3.874  10.773
  503    H    TYR  69           HN       TYR  69   7.221   4.194  14.025
  504    HA   TYR  69           HA       TYR  69   4.738   5.620  14.601
  505   1HB   TYR  69          HB2       TYR  69   5.713   3.850  16.150
  506   2HB   TYR  69          HB1       TYR  69   6.966   5.023  16.542
  507    HD1  TYR  69           HD1      TYR  69   6.642   6.252  18.464
  508    HD2  TYR  69           HD2      TYR  69   3.238   4.913  16.294
  509    HE1  TYR  69           HE1      TYR  69   5.172   7.250  20.163
  510    HE2  TYR  69           HE2      TYR  69   1.760   5.908  17.986
  511    HH   TYR  69           HH       TYR  69   1.942   6.529  20.442
  512    H    ASP  70           HN       ASP  70   8.175   6.207  14.195
  513    HA   ASP  70           HA       ASP  70   7.956   8.908  15.178
  514   1HB   ASP  70          HB2       ASP  70  10.275   9.159  14.845
  515   2HB   ASP  70          HB1       ASP  70  10.057   7.510  15.410
  516    HA   PRO  71           HA       PRO  71   7.964  10.007  10.559
  517   1HB   PRO  71          HB2       PRO  71   7.170   7.807   8.924
  518   2HB   PRO  71          HB1       PRO  71   8.733   8.621   8.945
  519   1HG   PRO  71          HG2       PRO  71   8.296   6.009   9.745
  520   2HG   PRO  71          HG1       PRO  71   9.685   7.001  10.221
  521   1HD   PRO  71          HD2       PRO  71   7.175   6.400  11.730
  522   2HD   PRO  71          HD1       PRO  71   8.844   6.541  12.323
  523    HA   PRO  72           HA       PRO  72   3.543  10.293  11.264
  524   1HB   PRO  72          HB2       PRO  72   3.678  12.655   9.541
  525   2HB   PRO  72          HB1       PRO  72   3.290  12.548  11.259
  526   1HG   PRO  72          HG2       PRO  72   5.583  13.649  10.367
  527   2HG   PRO  72          HG1       PRO  72   5.487  12.769  11.904
  528   1HD   PRO  72          HD2       PRO  72   6.517  11.838   9.248
  529   2HD   PRO  72          HD1       PRO  72   7.195  11.587  10.872
  530    H    GLU  73           HN       GLU  73   4.419   8.548   9.166
  531    HA   GLU  73           HA       GLU  73   2.831   9.322   6.824
  532   1HB   GLU  73          HB2       GLU  73   4.651   6.936   7.172
  533   2HB   GLU  73          HB1       GLU  73   3.970   7.536   5.667
  534   1HG   GLU  73          HG2       GLU  73   5.301   9.538   5.814
  535   2HG   GLU  73          HG1       GLU  73   5.925   9.039   7.387
  536    H    GLY  74           HN       GLY  74   3.311   6.532   8.986
  537   1HA   GLY  74          HA2       GLY  74   1.630   5.151   9.870
  538   2HA   GLY  74          HA1       GLY  74   0.482   5.868   8.749
  539    H    TRP  75           HN       TRP  75   3.068   3.526   9.097
  540    HA   TRP  75           HA       TRP  75   1.901   1.957   6.953
  541   1HB   TRP  75          HB2       TRP  75   4.219   1.546   5.981
  542   2HB   TRP  75          HB1       TRP  75   3.473   3.095   5.620
  543    HD1  TRP  75           HD1      TRP  75   4.750   5.231   6.311
  544    HE1  TRP  75           HE1      TRP  75   7.027   5.702   7.408
  545    HE3  TRP  75           HE3      TRP  75   5.887   0.483   7.877
  546    HZ2  TRP  75           HZ2      TRP  75   9.032   4.250   8.769
  547    HZ3  TRP  75           HZ3      TRP  75   8.008   0.120   9.067
  548    HH2  TRP  75           HH2      TRP  75   9.546   1.964   9.503
  549    H    GLY  76           HN       GLY  76   2.709  -0.236   6.881
  550   1HA   GLY  76          HA2       GLY  76   3.819  -1.084   9.482
  551   2HA   GLY  76          HA1       GLY  76   2.475  -1.919   8.716
  552    H    TRP  77           HN       TRP  77   5.248  -2.741   9.492
  553    HA   TRP  77           HA       TRP  77   6.089  -3.781   6.863
  554   1HB   TRP  77          HB2       TRP  77   7.752  -2.243   7.733
  555   2HB   TRP  77          HB1       TRP  77   7.759  -3.071   9.281
  556    HD1  TRP  77           HD1      TRP  77   9.125  -5.365   9.446
  557    HE1  TRP  77           HE1      TRP  77  10.980  -6.374   7.966
  558    HE3  TRP  77           HE3      TRP  77   8.533  -2.432   5.299
  559    HZ2  TRP  77           HZ2      TRP  77  12.040  -5.972   5.385
  560    HZ3  TRP  77           HZ3      TRP  77  10.012  -2.808   3.370
  561    HH2  TRP  77           HH2      TRP  77  11.730  -4.541   3.414
  562    H    CYS  78           HN       CYS  78   6.044  -5.921   6.646
  563    HA   CYS  78           HA       CYS  78   5.506  -7.550   9.028
  564   1HB   CYS  78          HB2       CYS  78   4.326  -7.529   6.528
  565   2HB   CYS  78          HB1       CYS  78   5.425  -8.898   6.422
  566    H    TYR  79           HN       TYR  79   7.291  -8.317   9.959
  567    HA   TYR  79           HA       TYR  79   9.844  -8.139   8.941
  568   1HB   TYR  79          HB2       TYR  79   8.683  -9.765  11.171
  569   2HB   TYR  79          HB1       TYR  79  10.389  -9.906  10.759
  570    HD1  TYR  79           HD1      TYR  79  11.722  -7.682  10.650
  571    HD2  TYR  79           HD2      TYR  79   8.004  -8.114  12.672
  572    HE1  TYR  79           HE1      TYR  79  12.245  -5.711  12.016
  573    HE2  TYR  79           HE2      TYR  79   8.517  -6.137  14.043
  574    HH   TYR  79           HH       TYR  79  10.571  -4.913  14.812
  575    H    VAL  80           HN       VAL  80   8.092 -11.247   9.315
  576    HA   VAL  80           HA       VAL  80  10.133 -12.743   8.066
  577    HB   VAL  80           HB       VAL  80   8.384 -14.556   7.878
  578   1HG1  VAL  80          HG11      VAL  80   8.279 -14.927  10.295
  579   2HG1  VAL  80          HG12      VAL  80   8.777 -13.258  10.571
  580   3HG1  VAL  80          HG13      VAL  80   9.881 -14.389   9.789
  581   1HG2  VAL  80          HG21      VAL  80   6.268 -14.217   9.031
  582   2HG2  VAL  80          HG22      VAL  80   6.426 -13.093   7.681
  583   3HG2  VAL  80          HG23      VAL  80   6.686 -12.531   9.333
  584    H    ASP  81           HN       ASP  81   7.586 -10.875   6.753
  585    HA   ASP  81           HA       ASP  81   7.600 -12.259   4.192
  586   1HB   ASP  81          HB2       ASP  81   6.160  -9.717   4.982
  587   2HB   ASP  81          HB1       ASP  81   5.877 -10.672   3.532
  588    H    GLU  82           HN       GLU  82   8.884  -9.452   5.739
  589    HA   GLU  82           HA       GLU  82  10.231  -7.757   5.130
  590   1HB   GLU  82          HB2       GLU  82  10.966  -9.604   2.851
  591   2HB   GLU  82          HB1       GLU  82  11.848  -8.148   3.298
  592   1HG   GLU  82          HG2       GLU  82  12.196  -9.155   5.559
  593   2HG   GLU  82          HG1       GLU  82  11.500 -10.647   4.932
  594    H    VAL  83           HN       VAL  83   7.482  -7.906   4.168
  595    HA   VAL  83           HA       VAL  83   7.708  -6.145   1.828
  596    HB   VAL  83           HB       VAL  83   5.348  -6.570   1.362
  597   1HG1  VAL  83          HG11      VAL  83   5.528  -8.894   0.640
  598   2HG1  VAL  83          HG12      VAL  83   6.934  -9.111   1.683
  599   3HG1  VAL  83          HG13      VAL  83   7.013  -7.998   0.317
  600   1HG2  VAL  83          HG21      VAL  83   4.093  -8.286   2.558
  601   2HG2  VAL  83          HG22      VAL  83   4.569  -6.979   3.643
  602   3HG2  VAL  83          HG23      VAL  83   5.443  -8.511   3.670
  603    H    MET  84           HN       MET  84   6.746  -4.175   1.827
  604    HA   MET  84           HA       MET  84   5.877  -3.165   4.457
  605   1HB   MET  84          HB2       MET  84   7.941  -2.156   3.579
  606   2HB   MET  84          HB1       MET  84   7.101  -1.707   2.103
  607   1HG   MET  84          HG2       MET  84   5.636  -0.229   3.415
  608   2HG   MET  84          HG1       MET  84   6.546  -0.652   4.868
  609   1HE   MET  84          HE1       MET  84   6.848   2.030   5.196
  610   2HE   MET  84          HE2       MET  84   6.050   2.357   3.658
  611   3HE   MET  84          HE3       MET  84   7.628   3.066   4.001
  612    H    PHE  85           HN       PHE  85   3.933  -2.187   4.639
  613    HA   PHE  85           HA       PHE  85   2.467  -1.435   2.225
  614   1HB   PHE  85          HB2       PHE  85   0.387  -2.497   3.160
  615   2HB   PHE  85          HB1       PHE  85   1.610  -3.648   2.640
  616    HD1  PHE  85           HD1      PHE  85  -0.188  -2.245   5.489
  617    HD2  PHE  85           HD2      PHE  85   2.819  -4.997   4.261
  618    HE1  PHE  85           HE1      PHE  85  -0.275  -3.322   7.697
  619    HE2  PHE  85           HE2      PHE  85   2.738  -6.076   6.472
  620    HZ   PHE  85           HZ       PHE  85   1.190  -5.239   8.193
  621    H    ASP  86           HN       ASP  86   0.856   0.194   2.624
  622    HA   ASP  86           HA       ASP  86   1.591   1.822   4.908
  623   1HB   ASP  86          HB2       ASP  86   0.516   3.616   3.869
  624   2HB   ASP  86          HB1       ASP  86   1.130   2.681   2.511
  625    H    LEU  87           HN       LEU  87   0.051   2.763   6.342
  626    HA   LEU  87           HA       LEU  87  -2.375   1.139   6.753
  627   1HB   LEU  87          HB2       LEU  87  -0.411   2.152   8.814
  628   2HB   LEU  87          HB1       LEU  87  -2.003   1.540   9.218
  629    HG   LEU  87           HG       LEU  87   0.169  -0.070   7.867
  630   1HD1  LEU  87          HD11      LEU  87   0.373  -1.220  10.009
  631   2HD1  LEU  87          HD12      LEU  87  -0.807  -0.119  10.720
  632   3HD1  LEU  87          HD13      LEU  87   0.753   0.495  10.173
  633   1HD2  LEU  87          HD21      LEU  87  -2.513  -0.869   8.994
  634   2HD2  LEU  87          HD22      LEU  87  -1.290  -1.974   8.367
  635   3HD2  LEU  87          HD23      LEU  87  -2.073  -0.821   7.286
  636    H    SER  88           HN       SER  88  -2.501   3.383   5.261
  637    HA   SER  88           HA       SER  88  -2.504   5.876   6.363
  638   1HB   SER  88          HB2       SER  88  -4.428   6.273   4.611
  639   2HB   SER  88          HB1       SER  88  -2.797   5.861   4.079
  640    HG   SER  88           HG       SER  88  -3.430   3.875   3.547
  641    H    ASP  89           HN       ASP  89  -5.259   3.602   6.473
  642    HA   ASP  89           HA       ASP  89  -6.670   5.569   8.138
  643   1HB   ASP  89          HB2       ASP  89  -7.653   3.228   6.530
  644   2HB   ASP  89          HB1       ASP  89  -8.657   3.996   7.755
  645    H    ARG  90           HN       ARG  90  -4.610   3.177   8.708
  646    HA   ARG  90           HA       ARG  90  -6.077   2.262  11.104
  647   1HB   ARG  90          HB2       ARG  90  -3.794   0.884   9.676
  648   2HB   ARG  90          HB1       ARG  90  -4.587   0.302  11.129
  649   1HG   ARG  90          HG2       ARG  90  -6.700   0.124   9.829
  650   2HG   ARG  90          HG1       ARG  90  -5.783   0.547   8.380
  651   1HD   ARG  90          HD2       ARG  90  -4.290  -1.389   8.833
  652   2HD   ARG  90          HD1       ARG  90  -5.346  -1.840  10.169
  653    HE   ARG  90           HE       ARG  90  -6.461  -1.630   7.460
  654   1HH1  ARG  90          HH11      ARG  90  -5.577  -3.574  10.240
  655   2HH1  ARG  90          HH12      ARG  90  -6.418  -4.993   9.679
  656   1HH2  ARG  90          HH21      ARG  90  -7.560  -3.503   6.709
  657   2HH2  ARG  90          HH22      ARG  90  -7.541  -4.946   7.679
  658    H    MET  91           HN       MET  91  -3.693   4.258  10.018
  659    HA   MET  91           HA       MET  91  -1.449   3.700  11.540
  660   1HB   MET  91          HB2       MET  91  -0.749   6.008  11.070
  661   2HB   MET  91          HB1       MET  91  -1.369   5.196   9.643
  662   1HG   MET  91          HG2       MET  91  -3.482   6.369   9.873
  663   2HG   MET  91          HG1       MET  91  -2.898   7.157  11.336
  664   1HE   MET  91          HE1       MET  91   0.146   7.795  10.557
  665   2HE   MET  91          HE2       MET  91  -0.936   8.910  11.392
  666   3HE   MET  91          HE3       MET  91  -0.043   9.447   9.969
  667    H    THR  92           HN       THR  92  -0.694   4.231  13.468
  668    HA   THR  92           HA       THR  92  -2.583   5.309  15.417
  669    HB   THR  92           HB       THR  92   0.182   4.246  15.995
  670    HG1  THR  92           HG1      THR  92  -0.714   2.519  15.020
  671   1HG2  THR  92          HG21      THR  92  -2.347   4.362  17.645
  672   2HG2  THR  92          HG22      THR  92  -0.955   5.431  17.814
  673   3HG2  THR  92          HG23      THR  92  -0.796   3.713  18.177
  674    HA   PRO  93           HA       PRO  93  -0.324   9.219  15.143
  675   1HB   PRO  93          HB2       PRO  93  -2.266  10.161  17.100
  676   2HB   PRO  93          HB1       PRO  93  -2.019  10.699  15.438
  677   1HG   PRO  93          HG2       PRO  93  -4.218   9.317  16.247
  678   2HG   PRO  93          HG1       PRO  93  -3.572   9.244  14.598
  679   1HD   PRO  93          HD2       PRO  93  -3.295   7.282  16.835
  680   2HD   PRO  93          HD1       PRO  93  -3.504   6.991  15.095
  681    H    HIS  94           HN       HIS  94   1.154  10.178  16.557
  682    HA   HIS  94           HA       HIS  94   1.961   8.627  18.764
  683   1HB   HIS  94          HB2       HIS  94   3.497  10.515  19.331
  684   2HB   HIS  94          HB1       HIS  94   3.642   9.931  17.683
  685    HD1  HIS  94           HD1      HIS  94   3.674  11.668  15.938
  686    HD2  HIS  94           HD2      HIS  94   1.938  13.043  19.462
  687    HE1  HIS  94           HE1      HIS  94   3.265  14.126  15.583
  688    HE2  HIS  94           HE2      HIS  94   2.369  14.966  17.785
  689    H    ASN  95           HN       ASN  95   1.536   8.673  20.857
  690    HA   ASN  95           HA       ASN  95  -0.847  10.150  21.615
  691   1HB   ASN  95          HB2       ASN  95  -0.894   8.673  23.572
  692   2HB   ASN  95          HB1       ASN  95  -0.740   7.750  22.083
  693   1HD2  ASN  95          HD21      ASN  95  -0.103   6.851  24.696
  694   2HD2  ASN  95          HD22      ASN  95   1.591   6.487  24.718
  695    H    GLY  96           HN       GLY  96   2.341  10.802  21.707
  696   1HA   GLY  96          HA2       GLY  96   1.924  12.938  23.602
  697   2HA   GLY  96          HA1       GLY  96   3.115  11.747  24.108
  698    HA   PRO  97           HA       PRO  97   5.040  14.944  21.213
  699   1HB   PRO  97          HB2       PRO  97   6.676  16.158  23.004
  700   2HB   PRO  97          HB1       PRO  97   5.024  16.703  22.691
  701   1HG   PRO  97          HG2       PRO  97   6.074  15.031  24.938
  702   2HG   PRO  97          HG1       PRO  97   4.887  16.347  24.980
  703   1HD   PRO  97          HD2       PRO  97   4.198  13.714  25.029
  704   2HD   PRO  97          HD1       PRO  97   3.161  14.976  24.336
  705    H    ILE  98           HN       ILE  98   6.417  13.736  20.068
  706    HA   ILE  98           HA       ILE  98   8.408  12.102  21.456
  707    HB   ILE  98           HB       ILE  98   7.696  12.202  18.521
  708   1HG1  ILE  98          HG12      ILE  98   6.961  10.232  20.697
  709   2HG1  ILE  98          HG11      ILE  98   5.863  11.321  19.855
  710   1HG2  ILE  98          HG21      ILE  98   9.986  11.496  18.824
  711   2HG2  ILE  98          HG22      ILE  98   8.996  10.107  18.373
  712   3HG2  ILE  98          HG23      ILE  98   9.496  10.327  20.050
  713   1HD1  ILE  98          HD11      ILE  98   7.365   9.012  18.650
  714   2HD1  ILE  98          HD12      ILE  98   6.323  10.125  17.761
  715   3HD1  ILE  98          HD13      ILE  98   5.639   9.080  19.006
  716    HA   PRO  99           HA       PRO  99  11.306  15.485  20.833
  717   1HB   PRO  99          HB2       PRO  99  13.180  13.447  21.892
  718   2HB   PRO  99          HB1       PRO  99  12.866  15.089  22.461
  719   1HG   PRO  99          HG2       PRO  99  11.977  12.969  23.818
  720   2HG   PRO  99          HG1       PRO  99  11.006  14.449  23.688
  721   1HD   PRO  99          HD2       PRO  99  10.723  11.857  22.219
  722   2HD   PRO  99          HD1       PRO  99   9.465  12.926  22.875
  723    H    ARG 100           HN       ARG 100  12.232  15.921  18.951
  724    HA   ARG 100           HA       ARG 100  13.010  13.773  17.174
  725   1HB   ARG 100          HB2       ARG 100  11.740  15.704  16.311
  726   2HB   ARG 100          HB1       ARG 100  13.065  16.769  16.756
  727   1HG   ARG 100          HG2       ARG 100  13.755  14.509  14.991
  728   2HG   ARG 100          HG1       ARG 100  12.726  15.762  14.296
  729   1HD   ARG 100          HD2       ARG 100  15.242  16.441  15.776
  730   2HD   ARG 100          HD1       ARG 100  15.275  16.007  14.067
  731    HE   ARG 100           HE       ARG 100  13.451  17.925  14.020
  732   1HH1  ARG 100          HH11      ARG 100  16.519  17.840  15.731
  733   2HH1  ARG 100          HH12      ARG 100  16.773  19.554  15.597
  734   1HH2  ARG 100          HH21      ARG 100  13.813  20.188  13.846
  735   2HH2  ARG 100          HH22      ARG 100  15.257  20.873  14.540
  736    H    TYR 101           HN       TYR 101  14.878  12.848  17.778
  737    HA   TYR 101           HA       TYR 101  17.131  14.475  18.601
  738   1HB   TYR 101          HB2       TYR 101  16.790  11.490  18.298
  739   2HB   TYR 101          HB1       TYR 101  18.301  12.249  18.785
  740    HD1  TYR 101           HD1      TYR 101  18.372  13.554  20.930
  741    HD2  TYR 101           HD2      TYR 101  15.051  11.126  19.852
  742    HE1  TYR 101           HE1      TYR 101  17.633  13.537  23.275
  743    HE2  TYR 101           HE2      TYR 101  14.301  11.104  22.191
  744    HH   TYR 101           HH       TYR 101  15.313  11.400  24.452
  745    H    VAL 102           HN       VAL 102  15.984  12.883  15.753
  746    HA   VAL 102           HA       VAL 102  18.545  13.030  14.415
  747    HB   VAL 102           HB       VAL 102  17.163  12.250  12.398
  748   1HG1  VAL 102          HG11      VAL 102  17.146   9.940  13.203
  749   2HG1  VAL 102          HG12      VAL 102  17.298  10.514  14.863
  750   3HG1  VAL 102          HG13      VAL 102  18.608  10.783  13.714
  751   1HG2  VAL 102          HG21      VAL 102  15.120  11.757  14.570
  752   2HG2  VAL 102          HG22      VAL 102  15.021  11.190  12.903
  753   3HG2  VAL 102          HG23      VAL 102  14.957  12.918  13.252
  Start of MODEL   14
    1   1H    MET   1          HT1       MET   1   6.185  -0.528  -2.593
    2   2H    MET   1          HT2       MET   1   7.087  -1.583  -1.619
    3   3H    MET   1          HT3       MET   1   6.875   0.031  -1.147
    4    HA   MET   1           HA       MET   1   5.471  -1.489   0.114
    5   1HB   MET   1          HB2       MET   1   4.802   0.879  -0.367
    6   2HB   MET   1          HB1       MET   1   3.887   0.294  -1.750
    7   1HG   MET   1          HG2       MET   1   2.491  -1.045  -0.255
    8   2HG   MET   1          HG1       MET   1   3.404  -0.443   1.127
    9   1HE   MET   1          HE1       MET   1   0.629   2.114  -1.528
   10   2HE   MET   1          HE2       MET   1   0.808   0.364  -1.669
   11   3HE   MET   1          HE3       MET   1   2.139   1.427  -2.126
   12    H    THR   2           HN       THR   2   3.896  -3.086   0.146
   13    HA   THR   2           HA       THR   2   2.958  -4.090  -2.443
   14    HB   THR   2           HB       THR   2   4.963  -5.402  -1.767
   15    HG1  THR   2           HG1      THR   2   3.509  -6.522  -3.017
   16   1HG2  THR   2          HG21      THR   2   3.253  -6.212   0.584
   17   2HG2  THR   2          HG22      THR   2   4.739  -5.264   0.650
   18   3HG2  THR   2          HG23      THR   2   4.789  -6.950   0.133
   19    H    MET   3           HN       MET   3   1.554  -6.290  -1.517
   20    HA   MET   3           HA       MET   3  -0.730  -4.927  -0.392
   21   1HB   MET   3          HB2       MET   3  -0.431  -7.832  -1.171
   22   2HB   MET   3          HB1       MET   3  -1.939  -6.988  -0.851
   23   1HG   MET   3          HG2       MET   3  -0.040  -6.480  -3.127
   24   2HG   MET   3          HG1       MET   3  -1.623  -7.250  -3.221
   25   1HE   MET   3          HE1       MET   3  -3.308  -5.378  -1.192
   26   2HE   MET   3          HE2       MET   3  -3.903  -5.983  -2.737
   27   3HE   MET   3          HE3       MET   3  -4.018  -4.263  -2.360
   28    H    GLY   4           HN       GLY   4  -1.799  -5.437   1.513
   29   1HA   GLY   4          HA2       GLY   4  -0.196  -6.208   3.715
   30   2HA   GLY   4          HA1       GLY   4  -1.938  -5.977   3.740
   31    H    CYS   5           HN       CYS   5  -0.166  -8.040   4.961
   32    HA   CYS   5           HA       CYS   5  -1.064 -10.462   3.591
   33   1HB   CYS   5          HB2       CYS   5   0.511 -11.644   5.049
   34   2HB   CYS   5          HB1       CYS   5   1.309 -10.330   4.192
   35    H    ARG   6           HN       ARG   6  -1.826 -12.292   5.061
   36    HA   ARG   6           HA       ARG   6  -4.179 -11.453   6.348
   37   1HB   ARG   6          HB2       ARG   6  -4.446 -13.807   7.020
   38   2HB   ARG   6          HB1       ARG   6  -4.038 -13.630   5.321
   39   1HG   ARG   6          HG2       ARG   6  -1.640 -14.098   5.994
   40   2HG   ARG   6          HG1       ARG   6  -2.285 -14.582   7.564
   41   1HD   ARG   6          HD2       ARG   6  -1.988 -16.513   6.100
   42   2HD   ARG   6          HD1       ARG   6  -3.692 -16.256   6.477
   43    HE   ARG   6           HE       ARG   6  -3.344 -14.907   4.140
   44   1HH1  ARG   6          HH11      ARG   6  -2.656 -18.200   5.139
   45   2HH1  ARG   6          HH12      ARG   6  -2.928 -18.867   3.555
   46   1HH2  ARG   6          HH21      ARG   6  -3.665 -15.775   2.063
   47   2HH2  ARG   6          HH22      ARG   6  -3.495 -17.488   1.806
   48    H    HIS   7           HN       HIS   7  -0.986 -11.790   7.588
   49    HA   HIS   7           HA       HIS   7  -1.487 -12.055  10.321
   50   1HB   HIS   7          HB2       HIS   7   0.671 -10.484   8.904
   51   2HB   HIS   7          HB1       HIS   7   0.637 -10.738  10.644
   52    HD2  HIS   7           HD2      HIS   7  -0.068 -13.932  10.639
   53    HE1  HIS   7           HE1      HIS   7   3.435 -14.206   8.289
   54    HE2  HIS   7           HE2      HIS   7   1.882 -15.457   9.848
   55    H    VAL   8           HN       VAL   8  -2.077  -9.403   8.183
   56    HA   VAL   8           HA       VAL   8  -2.183  -7.269   9.989
   57    HB   VAL   8           HB       VAL   8  -2.816  -7.683   7.258
   58   1HG1  VAL   8          HG11      VAL   8  -5.022  -6.228   8.704
   59   2HG1  VAL   8          HG12      VAL   8  -5.178  -7.769   7.860
   60   3HG1  VAL   8          HG13      VAL   8  -4.803  -6.302   6.956
   61   1HG2  VAL   8          HG21      VAL   8  -2.686  -5.180   8.924
   62   2HG2  VAL   8          HG22      VAL   8  -2.625  -5.236   7.162
   63   3HG2  VAL   8          HG23      VAL   8  -1.338  -5.977   8.114
   64    H    ALA   9           HN       ALA   9  -4.428  -9.879   9.406
   65    HA   ALA   9           HA       ALA   9  -6.659  -8.691  10.712
   66   1HB   ALA   9          HB1       ALA   9  -7.626 -10.916  10.699
   67   2HB   ALA   9          HB2       ALA   9  -6.059 -11.618  10.297
   68   3HB   ALA   9          HB3       ALA   9  -6.879 -10.570   9.140
   69    H    GLY  10           HN       GLY  10  -3.740 -10.034  11.834
   70   1HA   GLY  10          HA2       GLY  10  -4.811 -10.741  14.454
   71   2HA   GLY  10          HA1       GLY  10  -3.162 -10.989  13.902
   72    H    ILE  11           HN       ILE  11  -3.506  -7.997  12.940
   73    HA   ILE  11           HA       ILE  11  -2.582  -6.898  15.499
   74    HB   ILE  11           HB       ILE  11  -1.655  -5.023  14.222
   75   1HG1  ILE  11          HG12      ILE  11  -2.527  -6.548  11.759
   76   2HG1  ILE  11          HG11      ILE  11  -3.320  -5.100  12.367
   77   1HG2  ILE  11          HG21      ILE  11  -0.259  -6.947  14.673
   78   2HG2  ILE  11          HG22      ILE  11   0.141  -6.261  13.098
   79   3HG2  ILE  11          HG23      ILE  11  -0.826  -7.733  13.200
   80   1HD1  ILE  11          HD11      ILE  11  -0.475  -5.270  11.399
   81   2HD1  ILE  11          HD12      ILE  11  -1.290  -3.818  11.983
   82   3HD1  ILE  11          HD13      ILE  11  -1.843  -4.606  10.503
   83    H    ARG  12           HN       ARG  12  -3.312  -4.843  16.197
   84    HA   ARG  12           HA       ARG  12  -5.861  -3.970  15.052
   85   1HB   ARG  12          HB2       ARG  12  -6.918  -3.811  17.210
   86   2HB   ARG  12          HB1       ARG  12  -6.331  -5.449  16.999
   87   1HG   ARG  12          HG2       ARG  12  -4.864  -3.346  18.574
   88   2HG   ARG  12          HG1       ARG  12  -6.021  -4.472  19.281
   89   1HD   ARG  12          HD2       ARG  12  -3.414  -5.132  17.927
   90   2HD   ARG  12          HD1       ARG  12  -3.811  -5.326  19.631
   91    HE   ARG  12           HE       ARG  12  -5.394  -6.826  17.684
   92   1HH1  ARG  12          HH11      ARG  12  -2.873  -6.821  20.119
   93   2HH1  ARG  12          HH12      ARG  12  -2.908  -8.543  20.340
   94   1HH2  ARG  12          HH21      ARG  12  -5.430  -9.082  17.959
   95   2HH2  ARG  12          HH22      ARG  12  -4.352  -9.834  19.086
   96    H    THR  13           HN       THR  13  -6.533  -1.821  16.266
   97    HA   THR  13           HA       THR  13  -4.303  -0.007  16.049
   98    HB   THR  13           HB       THR  13  -7.137   0.528  16.982
   99    HG1  THR  13           HG1      THR  13  -6.607  -0.233  14.683
  100   1HG2  THR  13          HG21      THR  13  -5.543   2.241  17.723
  101   2HG2  THR  13          HG22      THR  13  -6.631   2.871  16.486
  102   3HG2  THR  13          HG23      THR  13  -4.976   2.432  16.063
  103    H    VAL  14           HN       VAL  14  -2.851  -0.042  17.613
  104    HA   VAL  14           HA       VAL  14  -3.648  -0.726  20.332
  105    HB   VAL  14           HB       VAL  14  -1.195  -0.931  20.738
  106   1HG1  VAL  14          HG11      VAL  14  -2.282  -2.509  18.413
  107   2HG1  VAL  14          HG12      VAL  14  -2.494  -2.884  20.123
  108   3HG1  VAL  14          HG13      VAL  14  -0.889  -2.963  19.395
  109   1HG2  VAL  14          HG21      VAL  14  -0.992  -0.387  17.776
  110   2HG2  VAL  14          HG22      VAL  14   0.328  -0.912  18.821
  111   3HG2  VAL  14          HG23      VAL  14  -0.414   0.669  19.065
  112    H    THR  15           HN       THR  15  -2.212   0.421  22.055
  113    HA   THR  15           HA       THR  15  -2.100   3.307  21.448
  114    HB   THR  15           HB       THR  15  -2.699   2.015  24.124
  115    HG1  THR  15           HG1      THR  15  -4.360   2.206  22.242
  116   1HG2  THR  15          HG21      THR  15  -3.157   4.300  24.885
  117   2HG2  THR  15          HG22      THR  15  -2.659   4.925  23.313
  118   3HG2  THR  15          HG23      THR  15  -1.483   4.126  24.356
  119    HA   PRO  16           HA       PRO  16   2.270   2.671  22.078
  120   1HB   PRO  16          HB2       PRO  16   2.301   5.615  22.369
  121   2HB   PRO  16          HB1       PRO  16   3.175   4.588  21.228
  122   1HG   PRO  16          HG2       PRO  16   1.113   6.100  20.441
  123   2HG   PRO  16          HG1       PRO  16   1.404   4.493  19.748
  124   1HD   PRO  16          HD2       PRO  16  -0.602   5.342  21.798
  125   2HD   PRO  16          HD1       PRO  16  -0.774   4.187  20.459
  126    H    SER  17           HN       SER  17   2.994   1.976  23.986
  127    HA   SER  17           HA       SER  17   2.170   3.199  26.455
  128   1HB   SER  17          HB2       SER  17   2.552   0.740  26.226
  129   2HB   SER  17          HB1       SER  17   4.274   1.062  26.027
  130    HG   SER  17           HG       SER  17   2.856   2.039  28.274
  131    H    ALA  18           HN       ALA  18   4.792   3.550  24.269
  132    HA   ALA  18           HA       ALA  18   6.100   5.386  26.155
  133   1HB   ALA  18          HB1       ALA  18   7.471   3.370  25.973
  134   2HB   ALA  18          HB2       ALA  18   8.282   4.749  25.229
  135   3HB   ALA  18          HB3       ALA  18   7.497   3.536  24.217
  136    H    LEU  19           HN       LEU  19   6.978   7.256  25.224
  137    HA   LEU  19           HA       LEU  19   5.700   8.089  22.781
  138   1HB   LEU  19          HB2       LEU  19   7.630   9.498  24.630
  139   2HB   LEU  19          HB1       LEU  19   6.960  10.236  23.191
  140    HG   LEU  19           HG       LEU  19   4.671   9.915  24.200
  141   1HD1  LEU  19          HD11      LEU  19   4.511   9.563  26.596
  142   2HD1  LEU  19          HD12      LEU  19   6.255   9.319  26.693
  143   3HD1  LEU  19          HD13      LEU  19   5.251   8.166  25.814
  144   1HD2  LEU  19          HD21      LEU  19   5.802  12.066  24.227
  145   2HD2  LEU  19          HD22      LEU  19   6.637  11.622  25.716
  146   3HD2  LEU  19          HD23      LEU  19   4.885  11.822  25.714
  147    H    GLY  20           HN       GLY  20   9.106   8.414  23.766
  148   1HA   GLY  20          HA2       GLY  20   9.946   7.823  21.042
  149   2HA   GLY  20          HA1       GLY  20  10.982   8.335  22.368
  150    H    CYS  21           HN       CYS  21  12.482   6.670  21.887
  151    HA   CYS  21           HA       CYS  21  11.599   3.925  22.018
  152   1HB   CYS  21          HB2       CYS  21  13.418   4.493  20.497
  153   2HB   CYS  21          HB1       CYS  21  14.384   5.089  21.845
  154    HG   CYS  21           HG       CYS  21  13.330   1.896  22.065
  155    H    GLU  22           HN       GLU  22  11.010   3.206  23.931
  156    HA   GLU  22           HA       GLU  22  11.624   3.980  26.460
  157   1HB   GLU  22          HB2       GLU  22   9.974   2.265  25.961
  158   2HB   GLU  22          HB1       GLU  22  11.237   1.159  25.440
  159   1HG   GLU  22          HG2       GLU  22  12.126   1.534  27.880
  160   2HG   GLU  22          HG1       GLU  22  10.448   1.990  28.182
  161    H    GLU  23           HN       GLU  23  13.461   1.694  24.488
  162    HA   GLU  23           HA       GLU  23  15.308   0.849  26.388
  163   1HB   GLU  23          HB2       GLU  23  14.801   0.053  23.937
  164   2HB   GLU  23          HB1       GLU  23  16.090   1.172  23.516
  165   1HG   GLU  23          HG2       GLU  23  16.878  -1.131  23.783
  166   2HG   GLU  23          HG1       GLU  23  17.641  -0.017  24.919
  167    H    CYS  24           HN       CYS  24  15.853   3.272  23.823
  168    HA   CYS  24           HA       CYS  24  18.290   4.205  24.813
  169   1HB   CYS  24          HB2       CYS  24  16.240   5.692  23.160
  170   2HB   CYS  24          HB1       CYS  24  17.938   6.126  23.331
  171    HG   CYS  24           HG       CYS  24  18.510   4.919  21.135
  172    H    LEU  25           HN       LEU  25  14.980   5.137  25.585
  173    HA   LEU  25           HA       LEU  25  15.624   7.563  26.903
  174   1HB   LEU  25          HB2       LEU  25  13.205   5.781  27.089
  175   2HB   LEU  25          HB1       LEU  25  13.329   7.331  27.896
  176    HG   LEU  25           HG       LEU  25  13.438   6.911  24.908
  177   1HD1  LEU  25          HD11      LEU  25  11.236   7.978  24.910
  178   2HD1  LEU  25          HD12      LEU  25  11.253   8.005  26.673
  179   3HD1  LEU  25          HD13      LEU  25  11.227   6.464  25.815
  180   1HD2  LEU  25          HD21      LEU  25  13.279   9.350  24.792
  181   2HD2  LEU  25          HD22      LEU  25  14.746   8.840  25.627
  182   3HD2  LEU  25          HD23      LEU  25  13.369   9.441  26.550
  183    H    LYS  26           HN       LYS  26  15.852   4.271  27.934
  184    HA   LYS  26           HA       LYS  26  15.438   4.768  30.713
  185   1HB   LYS  26          HB2       LYS  26  15.977   2.520  31.082
  186   2HB   LYS  26          HB1       LYS  26  15.271   2.519  29.474
  187   1HG   LYS  26          HG2       LYS  26  17.711   2.683  28.648
  188   2HG   LYS  26          HG1       LYS  26  18.129   2.158  30.279
  189   1HD   LYS  26          HD2       LYS  26  16.333   0.694  28.345
  190   2HD   LYS  26          HD1       LYS  26  17.992   0.260  28.750
  191   1HE   LYS  26          HE2       LYS  26  17.355  -0.189  31.037
  192   2HE   LYS  26          HE1       LYS  26  15.710   0.361  30.717
  193   1HZ   LYS  26          HZ1       LYS  26  15.804  -2.032  30.677
  194   2HZ   LYS  26          HZ2       LYS  26  17.033  -2.014  29.511
  195   3HZ   LYS  26          HZ3       LYS  26  15.480  -1.463  29.114
  196    H    ILE  27           HN       ILE  27  18.088   5.247  28.589
  197    HA   ILE  27           HA       ILE  27  19.827   5.772  30.912
  198    HB   ILE  27           HB       ILE  27  21.768   5.406  29.384
  199   1HG1  ILE  27          HG12      ILE  27  19.658   4.259  27.539
  200   2HG1  ILE  27          HG11      ILE  27  20.566   5.740  27.253
  201   1HG2  ILE  27          HG21      ILE  27  21.660   2.966  29.476
  202   2HG2  ILE  27          HG22      ILE  27  19.921   3.051  29.756
  203   3HG2  ILE  27          HG23      ILE  27  21.040   3.693  30.959
  204   1HD1  ILE  27          HD11      ILE  27  22.630   4.463  27.132
  205   2HD1  ILE  27          HD12      ILE  27  21.446   3.874  25.964
  206   3HD1  ILE  27          HD13      ILE  27  21.738   2.977  27.454
  207    H    GLY  28           HN       GLY  28  18.103   7.207  28.461
  208   1HA   GLY  28          HA2       GLY  28  17.986   9.468  27.927
  209   2HA   GLY  28          HA1       GLY  28  19.457   9.733  28.853
  210    H    SER  29           HN       SER  29  18.826   7.553  26.146
  211    HA   SER  29           HA       SER  29  21.050   8.830  24.702
  212   1HB   SER  29          HB2       SER  29  21.487   6.497  25.282
  213   2HB   SER  29          HB1       SER  29  19.964   6.003  24.547
  214    HG   SER  29           HG       SER  29  20.936   7.016  22.560
  215    HA   PRO  30           HA       PRO  30  18.120   9.825  21.472
  216   1HB   PRO  30          HB2       PRO  30  19.836  10.212  19.425
  217   2HB   PRO  30          HB1       PRO  30  19.678  11.367  20.754
  218   1HG   PRO  30          HG2       PRO  30  21.754   9.257  20.315
  219   2HG   PRO  30          HG1       PRO  30  21.956  10.927  20.874
  220   1HD   PRO  30          HD2       PRO  30  21.931   8.781  22.553
  221   2HD   PRO  30          HD1       PRO  30  21.396  10.402  23.037
  222    H    TRP  31           HN       TRP  31  17.661   9.123  19.169
  223    HA   TRP  31           HA       TRP  31  18.590   6.430  18.531
  224   1HB   TRP  31          HB2       TRP  31  16.274   5.697  18.038
  225   2HB   TRP  31          HB1       TRP  31  16.509   6.057  19.745
  226    HD1  TRP  31           HD1      TRP  31  14.825   7.521  16.598
  227    HE1  TRP  31           HE1      TRP  31  12.955   9.123  17.349
  228    HE3  TRP  31           HE3      TRP  31  15.689   7.453  21.636
  229    HZ2  TRP  31           HZ2      TRP  31  11.976  10.205  19.768
  230    HZ3  TRP  31           HZ3      TRP  31  14.240   8.798  23.098
  231    HH2  TRP  31           HH2      TRP  31  12.423  10.145  22.181
  232    H    VAL  32           HN       VAL  32  17.431   5.862  16.280
  233    HA   VAL  32           HA       VAL  32  17.864   8.216  14.573
  234    HB   VAL  32           HB       VAL  32  17.798   5.315  13.725
  235   1HG1  VAL  32          HG11      VAL  32  18.696   7.806  12.277
  236   2HG1  VAL  32          HG12      VAL  32  17.239   6.870  11.939
  237   3HG1  VAL  32          HG13      VAL  32  18.829   6.157  11.664
  238   1HG2  VAL  32          HG21      VAL  32  20.231   5.454  13.584
  239   2HG2  VAL  32          HG22      VAL  32  19.678   5.738  15.234
  240   3HG2  VAL  32          HG23      VAL  32  20.182   7.095  14.228
  241    H    HIS  33           HN       HIS  33  15.781   5.322  14.715
  242    HA   HIS  33           HA       HIS  33  13.487   6.996  14.028
  243   1HB   HIS  33          HB2       HIS  33  14.192   4.444  12.553
  244   2HB   HIS  33          HB1       HIS  33  12.663   5.297  12.403
  245    HD1  HIS  33           HD1      HIS  33  15.693   4.875  10.661
  246    HD2  HIS  33           HD2      HIS  33  13.292   8.173  11.519
  247    HE1  HIS  33           HE1      HIS  33  16.306   6.633   8.962
  248    HE2  HIS  33           HE2      HIS  33  14.814   8.603   9.465
  249    H    LEU  34           HN       LEU  34  11.425   5.813  14.406
  250    HA   LEU  34           HA       LEU  34  11.736   3.878  16.603
  251   1HB   LEU  34          HB2       LEU  34   9.625   5.994  16.198
  252   2HB   LEU  34          HB1       LEU  34   9.573   4.771  17.454
  253    HG   LEU  34           HG       LEU  34  11.682   6.912  17.176
  254   1HD1  LEU  34          HD11      LEU  34  10.679   7.827  19.208
  255   2HD1  LEU  34          HD12      LEU  34   9.425   6.588  19.147
  256   3HD1  LEU  34          HD13      LEU  34   9.527   7.803  17.872
  257   1HD2  LEU  34          HD21      LEU  34  11.256   4.839  19.323
  258   2HD2  LEU  34          HD22      LEU  34  12.463   6.125  19.344
  259   3HD2  LEU  34          HD23      LEU  34  12.561   4.843  18.137
  260    H    ARG  35           HN       ARG  35  10.573   2.066  16.587
  261    HA   ARG  35           HA       ARG  35   8.594   1.689  14.431
  262   1HB   ARG  35          HB2       ARG  35  10.473  -0.364  15.634
  263   2HB   ARG  35          HB1       ARG  35   9.231  -0.707  14.439
  264   1HG   ARG  35          HG2       ARG  35  11.479   1.220  13.925
  265   2HG   ARG  35          HG1       ARG  35  11.607  -0.508  13.595
  266   1HD   ARG  35          HD2       ARG  35   9.713  -0.372  12.070
  267   2HD   ARG  35          HD1       ARG  35   9.528   1.343  12.432
  268    HE   ARG  35           HE       ARG  35  11.568   1.768  11.268
  269   1HH1  ARG  35          HH11      ARG  35  10.440  -1.534  10.967
  270   2HH1  ARG  35          HH12      ARG  35  11.392  -1.864   9.559
  271   1HH2  ARG  35          HH21      ARG  35  12.810   1.341   9.396
  272   2HH2  ARG  35          HH22      ARG  35  12.751  -0.241   8.672
  273    H    ILE  36           HN       ILE  36   6.607   1.569  15.291
  274    HA   ILE  36           HA       ILE  36   6.322   0.674  18.076
  275    HB   ILE  36           HB       ILE  36   5.258   2.803  17.575
  276   1HG1  ILE  36          HG12      ILE  36   3.202   0.614  17.939
  277   2HG1  ILE  36          HG11      ILE  36   4.213   1.279  19.217
  278   1HG2  ILE  36          HG21      ILE  36   4.864   2.519  15.194
  279   2HG2  ILE  36          HG22      ILE  36   3.374   2.975  16.020
  280   3HG2  ILE  36          HG23      ILE  36   3.632   1.302  15.528
  281   1HD1  ILE  36          HD11      ILE  36   1.978   2.210  19.287
  282   2HD1  ILE  36          HD12      ILE  36   2.151   2.787  17.630
  283   3HD1  ILE  36          HD13      ILE  36   3.165   3.458  18.908
  284    H    CYS  37           HN       CYS  37   5.477  -1.155  18.602
  285    HA   CYS  37           HA       CYS  37   5.015  -3.126  16.570
  286   1HB   CYS  37          HB2       CYS  37   6.250  -3.568  18.641
  287   2HB   CYS  37          HB1       CYS  37   4.802  -3.230  19.576
  288    H    ARG  38           HN       ARG  38   3.105  -3.494  15.626
  289    HA   ARG  38           HA       ARG  38   0.754  -2.110  16.464
  290   1HB   ARG  38          HB2       ARG  38   1.272  -4.125  14.289
  291   2HB   ARG  38          HB1       ARG  38  -0.313  -3.424  14.570
  292   1HG   ARG  38          HG2       ARG  38   2.183  -1.888  13.882
  293   2HG   ARG  38          HG1       ARG  38   0.879  -2.298  12.766
  294   1HD   ARG  38          HD2       ARG  38   0.756  -0.483  15.165
  295   2HD   ARG  38          HD1       ARG  38   0.544  -0.048  13.470
  296    HE   ARG  38           HE       ARG  38  -1.365  -1.726  14.974
  297   1HH1  ARG  38          HH11      ARG  38  -0.662   0.707  12.540
  298   2HH1  ARG  38          HH12      ARG  38  -2.342   1.058  12.260
  299   1HH2  ARG  38          HH21      ARG  38  -3.559  -1.243  14.584
  300   2HH2  ARG  38          HH22      ARG  38  -3.974  -0.026  13.410
  301    H    THR  39           HN       THR  39   2.033  -4.874  17.691
  302    HA   THR  39           HA       THR  39  -0.507  -6.269  17.982
  303    HB   THR  39           HB       THR  39   2.079  -7.171  19.211
  304    HG1  THR  39           HG1      THR  39   1.445  -8.088  16.643
  305   1HG2  THR  39          HG21      THR  39   1.125  -9.392  18.780
  306   2HG2  THR  39          HG22      THR  39  -0.290  -8.640  18.042
  307   3HG2  THR  39          HG23      THR  39   0.041  -8.405  19.759
  308    H    CYS  40           HN       CYS  40   2.045  -4.915  20.060
  309    HA   CYS  40           HA       CYS  40   0.158  -5.067  22.312
  310   1HB   CYS  40          HB2       CYS  40   2.062  -5.442  23.791
  311   2HB   CYS  40          HB1       CYS  40   2.043  -6.645  22.510
  312    H    GLY  41           HN       GLY  41   1.547  -2.931  20.269
  313   1HA   GLY  41          HA2       GLY  41   1.551  -0.636  20.307
  314   2HA   GLY  41          HA1       GLY  41   0.810  -0.721  21.894
  315    H    HIS  42           HN       HIS  42   3.848  -2.351  21.479
  316    HA   HIS  42           HA       HIS  42   5.037  -0.315  23.208
  317   1HB   HIS  42          HB2       HIS  42   5.146  -2.825  23.749
  318   2HB   HIS  42          HB1       HIS  42   6.340  -2.927  22.458
  319    HD1  HIS  42           HD1      HIS  42   8.670  -1.901  22.911
  320    HD2  HIS  42           HD2      HIS  42   6.016  -1.515  26.085
  321    HE1  HIS  42           HE1      HIS  42  10.053  -1.126  24.854
  322    HE2  HIS  42           HE2      HIS  42   8.457  -1.025  26.798
  323    H    VAL  43           HN       VAL  43   6.677   0.960  22.606
  324    HA   VAL  43           HA       VAL  43   7.365   0.958  19.768
  325    HB   VAL  43           HB       VAL  43   7.930   3.063  21.867
  326   1HG1  VAL  43          HG11      VAL  43   8.287   4.551  19.961
  327   2HG1  VAL  43          HG12      VAL  43   8.017   3.204  18.855
  328   3HG1  VAL  43          HG13      VAL  43   9.412   3.193  19.934
  329   1HG2  VAL  43          HG21      VAL  43   6.026   4.277  20.927
  330   2HG2  VAL  43          HG22      VAL  43   5.530   2.726  21.604
  331   3HG2  VAL  43          HG23      VAL  43   5.686   2.918  19.857
  332    H    GLY  44           HN       GLY  44   9.406   0.688  19.014
  333   1HA   GLY  44          HA2       GLY  44  11.601   0.511  20.970
  334   2HA   GLY  44          HA1       GLY  44  11.360  -0.782  19.800
  335    H    CYS  45           HN       CYS  45  13.753   0.619  19.914
  336    HA   CYS  45           HA       CYS  45  13.805   2.728  17.991
  337   1HB   CYS  45          HB2       CYS  45  16.263   2.453  18.100
  338   2HB   CYS  45          HB1       CYS  45  15.541   2.590  19.700
  339    HG   CYS  45           HG       CYS  45  16.661  -0.271  18.204
  340    H    CYS  46           HN       CYS  46  14.415   2.671  15.879
  341    HA   CYS  46           HA       CYS  46  13.740   0.393  14.365
  342   1HB   CYS  46          HB2       CYS  46  13.602   2.785  13.629
  343   2HB   CYS  46          HB1       CYS  46  15.355   2.798  13.496
  344    HG   CYS  46           HG       CYS  46  15.193   2.288  10.990
  345    H    ASP  47           HN       ASP  47  15.288  -0.471  12.625
  346    HA   ASP  47           HA       ASP  47  17.417  -1.823  13.913
  347   1HB   ASP  47          HB2       ASP  47  17.870  -2.809  11.737
  348   2HB   ASP  47          HB1       ASP  47  16.132  -2.770  12.015
  349    H    ASP  48           HN       ASP  48  17.198   1.207  12.384
  350    HA   ASP  48           HA       ASP  48  19.875   1.573  11.553
  351   1HB   ASP  48          HB2       ASP  48  18.035   3.725  12.616
  352   2HB   ASP  48          HB1       ASP  48  19.388   3.930  11.511
  353    H    SER  49           HN       SER  49  18.229   1.878  14.618
  354    HA   SER  49           HA       SER  49  20.437   3.232  15.891
  355   1HB   SER  49          HB2       SER  49  17.889   2.136  17.104
  356   2HB   SER  49          HB1       SER  49  18.992   3.305  17.837
  357    HG   SER  49           HG       SER  49  18.407   4.341  15.548
  358    HA   PRO  50           HA       PRO  50  22.927  -0.221  16.885
  359   1HB   PRO  50          HB2       PRO  50  23.181   1.196  19.503
  360   2HB   PRO  50          HB1       PRO  50  24.441   0.541  18.450
  361   1HG   PRO  50          HG2       PRO  50  23.941   3.153  18.505
  362   2HG   PRO  50          HG1       PRO  50  24.328   2.330  16.983
  363   1HD   PRO  50          HD2       PRO  50  21.717   3.351  17.969
  364   2HD   PRO  50          HD1       PRO  50  22.323   3.206  16.310
  365    H    HIS  51           HN       HIS  51  20.489   0.764  19.263
  366    HA   HIS  51           HA       HIS  51  20.780  -1.519  20.921
  367   1HB   HIS  51          HB2       HIS  51  18.465   0.401  20.613
  368   2HB   HIS  51          HB1       HIS  51  18.531  -0.864  21.832
  369    HD1  HIS  51           HD1      HIS  51  19.314  -0.051  24.037
  370    HD2  HIS  51           HD2      HIS  51  20.903   2.187  20.912
  371    HE1  HIS  51           HE1      HIS  51  20.564   1.832  25.121
  372    HE2  HIS  51           HE2      HIS  51  21.731   3.016  23.219
  373    H    LYS  52           HN       LYS  52  18.756  -0.802  18.140
  374    HA   LYS  52           HA       LYS  52  17.183  -2.002  16.991
  375   1HB   LYS  52          HB2       LYS  52  19.359  -4.038  17.441
  376   2HB   LYS  52          HB1       LYS  52  18.019  -4.282  16.331
  377   1HG   LYS  52          HG2       LYS  52  18.714  -2.381  15.016
  378   2HG   LYS  52          HG1       LYS  52  20.007  -2.030  16.163
  379   1HD   LYS  52          HD2       LYS  52  19.754  -4.564  14.549
  380   2HD   LYS  52          HD1       LYS  52  20.812  -3.208  14.153
  381   1HE   LYS  52          HE2       LYS  52  21.963  -3.514  16.312
  382   2HE   LYS  52          HE1       LYS  52  20.932  -4.906  16.642
  383   1HZ   LYS  52          HZ1       LYS  52  22.701  -4.717  14.269
  384   2HZ   LYS  52          HZ2       LYS  52  21.883  -6.088  14.841
  385   3HZ   LYS  52          HZ3       LYS  52  23.173  -5.439  15.730
  386    H    HIS  53           HN       HIS  53  16.298  -1.875  19.612
  387    HA   HIS  53           HA       HIS  53  15.773  -4.511  20.590
  388   1HB   HIS  53          HB2       HIS  53  15.916  -2.444  22.051
  389   2HB   HIS  53          HB1       HIS  53  14.315  -2.012  21.452
  390    HD1  HIS  53           HD1      HIS  53  13.165  -2.327  23.757
  391    HD2  HIS  53           HD2      HIS  53  15.147  -5.715  22.380
  392    HE1  HIS  53           HE1      HIS  53  12.393  -4.216  25.224
  393    HE2  HIS  53           HE2      HIS  53  13.766  -6.201  24.508
  394    H    ALA  54           HN       ALA  54  14.312  -2.535  18.218
  395    HA   ALA  54           HA       ALA  54  11.650  -3.465  18.374
  396   1HB   ALA  54          HB1       ALA  54  12.269  -1.527  17.022
  397   2HB   ALA  54          HB2       ALA  54  11.438  -2.739  16.047
  398   3HB   ALA  54          HB3       ALA  54  13.190  -2.568  15.937
  399    H    THR  55           HN       THR  55  14.462  -4.645  16.548
  400    HA   THR  55           HA       THR  55  13.087  -6.857  15.399
  401    HB   THR  55           HB       THR  55  15.452  -7.671  14.920
  402    HG1  THR  55           HG1      THR  55  17.132  -6.282  15.423
  403   1HG2  THR  55          HG21      THR  55  14.166  -6.365  13.293
  404   2HG2  THR  55          HG22      THR  55  15.878  -5.942  13.237
  405   3HG2  THR  55          HG23      THR  55  14.731  -4.871  14.042
  406    H    ARG  56           HN       ARG  56  15.257  -6.436  18.154
  407    HA   ARG  56           HA       ARG  56  15.356  -9.102  19.013
  408   1HB   ARG  56          HB2       ARG  56  15.638  -6.496  20.506
  409   2HB   ARG  56          HB1       ARG  56  15.885  -8.061  21.270
  410   1HG   ARG  56          HG2       ARG  56  17.708  -8.557  19.777
  411   2HG   ARG  56          HG1       ARG  56  17.414  -7.070  18.875
  412   1HD   ARG  56          HD2       ARG  56  19.323  -6.981  20.507
  413   2HD   ARG  56          HD1       ARG  56  18.107  -5.721  20.697
  414    HE   ARG  56           HE       ARG  56  17.660  -6.523  22.783
  415   1HH1  ARG  56          HH11      ARG  56  19.337  -9.037  20.994
  416   2HH1  ARG  56          HH12      ARG  56  19.492 -10.088  22.372
  417   1HH2  ARG  56          HH21      ARG  56  17.855  -7.906  24.591
  418   2HH2  ARG  56          HH22      ARG  56  18.631  -9.453  24.409
  419    H    HIS  57           HN       HIS  57  12.940  -6.625  19.450
  420    HA   HIS  57           HA       HIS  57  11.485  -7.793  21.552
  421   1HB   HIS  57          HB2       HIS  57  11.102  -5.487  20.886
  422   2HB   HIS  57          HB1       HIS  57  10.555  -6.003  19.295
  423    HD1  HIS  57           HD1      HIS  57   9.466  -6.079  22.931
  424    HD2  HIS  57           HD2      HIS  57   7.925  -6.671  19.110
  425    HE1  HIS  57           HE1      HIS  57   6.961  -6.307  23.195
  426    H    PHE  58           HN       PHE  58  11.334  -8.226  18.052
  427    HA   PHE  58           HA       PHE  58   9.059  -9.898  18.025
  428   1HB   PHE  58          HB2       PHE  58   9.783  -8.872  15.975
  429   2HB   PHE  58          HB1       PHE  58  11.367  -9.630  16.093
  430    HD1  PHE  58           HD1      PHE  58   7.817 -10.806  16.199
  431    HD2  PHE  58           HD2      PHE  58  11.709 -11.274  14.568
  432    HE1  PHE  58           HE1      PHE  58   7.017 -12.699  14.848
  433    HE2  PHE  58           HE2      PHE  58  10.918 -13.165  13.208
  434    HZ   PHE  58           HZ       PHE  58   8.569 -13.882  13.349
  435    H    HIS  59           HN       HIS  59  12.478 -10.507  18.481
  436    HA   HIS  59           HA       HIS  59  12.311 -13.342  18.362
  437   1HB   HIS  59          HB2       HIS  59  14.425 -12.134  18.024
  438   2HB   HIS  59          HB1       HIS  59  14.375 -11.566  19.688
  439    HD1  HIS  59           HD1      HIS  59  14.690 -14.791  17.729
  440    HD2  HIS  59           HD2      HIS  59  15.528 -13.259  21.503
  441    HE1  HIS  59           HE1      HIS  59  16.008 -16.579  18.910
  442    HE2  HIS  59           HE2      HIS  59  16.309 -15.715  21.254
  443    H    ALA  60           HN       ALA  60  11.716 -10.979  20.825
  444    HA   ALA  60           HA       ALA  60  11.811 -12.897  22.989
  445   1HB   ALA  60          HB1       ALA  60  12.578 -10.623  23.377
  446   2HB   ALA  60          HB2       ALA  60  11.200 -11.002  24.410
  447   3HB   ALA  60          HB3       ALA  60  10.977 -10.002  22.975
  448    H    THR  61           HN       THR  61   9.289 -10.884  21.462
  449    HA   THR  61           HA       THR  61   7.260 -12.288  23.016
  450    HB   THR  61           HB       THR  61   5.685 -10.633  21.900
  451    HG1  THR  61           HG1      THR  61   8.190  -9.540  21.073
  452   1HG2  THR  61          HG21      THR  61   6.529 -10.339  24.192
  453   2HG2  THR  61          HG22      THR  61   6.325  -8.794  23.364
  454   3HG2  THR  61          HG23      THR  61   7.937  -9.488  23.556
  455    H    GLY  62           HN       GLY  62   8.225 -11.864  19.645
  456   1HA   GLY  62          HA2       GLY  62   7.715 -13.349  17.890
  457   2HA   GLY  62          HA1       GLY  62   6.454 -14.060  18.890
  458    H    HIS  63           HN       HIS  63   6.920 -10.633  18.277
  459    HA   HIS  63           HA       HIS  63   4.247 -10.559  17.048
  460   1HB   HIS  63          HB2       HIS  63   5.817  -8.369  18.438
  461   2HB   HIS  63          HB1       HIS  63   4.256  -8.138  17.662
  462    HD2  HIS  63           HD2      HIS  63   3.620 -11.314  19.300
  463    HE1  HIS  63           HE1      HIS  63   3.081  -8.437  22.364
  464    HE2  HIS  63           HE2      HIS  63   2.898 -10.905  21.762
  465    HA   PRO  64           HA       PRO  64   6.982 -10.021  13.570
  466   1HB   PRO  64          HB2       PRO  64   5.331 -10.884  11.662
  467   2HB   PRO  64          HB1       PRO  64   5.977 -11.981  12.888
  468   1HG   PRO  64          HG2       PRO  64   3.281 -10.696  12.728
  469   2HG   PRO  64          HG1       PRO  64   3.704 -12.355  13.188
  470   1HD   PRO  64          HD2       PRO  64   3.170 -10.314  14.974
  471   2HD   PRO  64          HD1       PRO  64   4.114 -11.766  15.354
  472    H    ILE  65           HN       ILE  65   4.417  -7.939  14.240
  473    HA   ILE  65           HA       ILE  65   4.907  -6.505  11.715
  474    HB   ILE  65           HB       ILE  65   2.263  -6.700  13.157
  475   1HG1  ILE  65          HG12      ILE  65   3.200  -7.661  10.442
  476   2HG1  ILE  65          HG11      ILE  65   2.778  -8.671  11.820
  477   1HG2  ILE  65          HG21      ILE  65   1.386  -5.301  11.327
  478   2HG2  ILE  65          HG22      ILE  65   3.031  -5.079  10.728
  479   3HG2  ILE  65          HG23      ILE  65   2.575  -4.447  12.310
  480   1HD1  ILE  65          HD11      ILE  65   1.015  -8.657  10.154
  481   2HD1  ILE  65          HD12      ILE  65   0.888  -6.903  10.286
  482   3HD1  ILE  65          HD13      ILE  65   0.465  -7.924  11.660
  483    H    ILE  66           HN       ILE  66   5.652  -4.559  11.870
  484    HA   ILE  66           HA       ILE  66   5.133  -2.982  14.303
  485    HB   ILE  66           HB       ILE  66   7.382  -1.942  14.000
  486   1HG1  ILE  66          HG12      ILE  66   7.838  -4.266  12.114
  487   2HG1  ILE  66          HG11      ILE  66   7.690  -2.581  11.627
  488   1HG2  ILE  66          HG21      ILE  66   7.369  -4.910  14.519
  489   2HG2  ILE  66          HG22      ILE  66   7.010  -3.646  15.694
  490   3HG2  ILE  66          HG23      ILE  66   8.633  -3.785  15.016
  491   1HD1  ILE  66          HD11      ILE  66  10.007  -3.285  11.676
  492   2HD1  ILE  66          HD12      ILE  66   9.850  -3.732  13.375
  493   3HD1  ILE  66          HD13      ILE  66   9.705  -2.042  12.891
  494    H    GLU  67           HN       GLU  67   5.240  -0.661  13.951
  495    HA   GLU  67           HA       GLU  67   4.630   0.104  11.173
  496   1HB   GLU  67          HB2       GLU  67   2.588  -0.065  12.534
  497   2HB   GLU  67          HB1       GLU  67   3.275   1.039  13.712
  498   1HG   GLU  67          HG2       GLU  67   3.156   2.862  12.198
  499   2HG   GLU  67          HG1       GLU  67   2.758   1.793  10.851
  500    H    GLY  68           HN       GLY  68   5.213   2.244  10.579
  501   1HA   GLY  68          HA2       GLY  68   7.590   3.219  11.837
  502   2HA   GLY  68          HA1       GLY  68   6.735   3.977  10.501
  503    H    TYR  69           HN       TYR  69   7.514   4.199  13.763
  504    HA   TYR  69           HA       TYR  69   5.198   5.858  14.415
  505   1HB   TYR  69          HB2       TYR  69   6.099   4.037  15.967
  506   2HB   TYR  69          HB1       TYR  69   7.454   5.116  16.274
  507    HD1  TYR  69           HD1      TYR  69   3.975   6.257  15.785
  508    HD2  TYR  69           HD2      TYR  69   7.055   5.438  18.600
  509    HE1  TYR  69           HE1      TYR  69   2.660   7.371  17.538
  510    HE2  TYR  69           HE2      TYR  69   5.751   6.554  20.359
  511    HH   TYR  69           HH       TYR  69   3.994   8.053  20.682
  512    H    ASP  70           HN       ASP  70   8.706   6.047  14.087
  513    HA   ASP  70           HA       ASP  70   8.866   8.805  14.796
  514   1HB   ASP  70          HB2       ASP  70  10.839   7.410  15.004
  515   2HB   ASP  70          HB1       ASP  70  10.825   7.062  13.286
  516    HA   PRO  71           HA       PRO  71   7.963   9.648  10.292
  517   1HB   PRO  71          HB2       PRO  71   8.130   7.664   8.413
  518   2HB   PRO  71          HB1       PRO  71   9.495   8.680   8.880
  519   1HG   PRO  71          HG2       PRO  71   9.121   5.860   9.345
  520   2HG   PRO  71          HG1       PRO  71  10.528   6.861   9.731
  521   1HD   PRO  71          HD2       PRO  71   8.314   5.980  11.475
  522   2HD   PRO  71          HD1       PRO  71   9.949   6.510  11.903
  523    HA   PRO  72           HA       PRO  72   4.084   7.423  11.385
  524   1HB   PRO  72          HB2       PRO  72   2.807   9.995  11.638
  525   2HB   PRO  72          HB1       PRO  72   3.220   8.845  12.909
  526   1HG   PRO  72          HG2       PRO  72   4.417  11.290  12.616
  527   2HG   PRO  72          HG1       PRO  72   5.188   9.897  13.395
  528   1HD   PRO  72          HD2       PRO  72   5.533  10.947  10.611
  529   2HD   PRO  72          HD1       PRO  72   6.756  10.325  11.742
  530    H    GLU  73           HN       GLU  73   4.772   7.556   8.741
  531    HA   GLU  73           HA       GLU  73   2.754   8.999   7.252
  532   1HB   GLU  73          HB2       GLU  73   4.836   7.008   6.331
  533   2HB   GLU  73          HB1       GLU  73   3.860   8.034   5.286
  534   1HG   GLU  73          HG2       GLU  73   4.923  10.004   6.100
  535   2HG   GLU  73          HG1       GLU  73   5.749   9.099   7.368
  536    H    GLY  74           HN       GLY  74   2.789   6.184   8.965
  537   1HA   GLY  74          HA2       GLY  74   1.108   4.618   9.204
  538   2HA   GLY  74          HA1       GLY  74   0.286   5.346   7.832
  539    H    TRP  75           HN       TRP  75   3.167   3.398   8.571
  540    HA   TRP  75           HA       TRP  75   2.406   1.614   6.398
  541   1HB   TRP  75          HB2       TRP  75   4.813   1.485   5.657
  542   2HB   TRP  75          HB1       TRP  75   3.998   2.996   5.276
  543    HD1  TRP  75           HD1      TRP  75   4.839   5.198   6.534
  544    HE1  TRP  75           HE1      TRP  75   7.020   5.738   7.787
  545    HE3  TRP  75           HE3      TRP  75   6.603   0.438   7.180
  546    HZ2  TRP  75           HZ2      TRP  75   9.199   4.332   8.899
  547    HZ3  TRP  75           HZ3      TRP  75   8.747   0.126   8.349
  548    HH2  TRP  75           HH2      TRP  75  10.015   2.035   9.188
  549    H    GLY  76           HN       GLY  76   3.011  -0.511   6.684
  550   1HA   GLY  76          HA2       GLY  76   4.064  -1.092   9.384
  551   2HA   GLY  76          HA1       GLY  76   2.772  -2.015   8.635
  552    H    TRP  77           HN       TRP  77   5.598  -2.566   9.636
  553    HA   TRP  77           HA       TRP  77   6.603  -3.927   7.223
  554   1HB   TRP  77          HB2       TRP  77   8.201  -2.329   8.168
  555   2HB   TRP  77          HB1       TRP  77   8.063  -3.096   9.746
  556    HD1  TRP  77           HD1      TRP  77   9.690  -5.052  10.247
  557    HE1  TRP  77           HE1      TRP  77  11.486  -6.308   8.892
  558    HE3  TRP  77           HE3      TRP  77   8.679  -3.155   5.609
  559    HZ2  TRP  77           HZ2      TRP  77  12.346  -6.476   6.212
  560    HZ3  TRP  77           HZ3      TRP  77  10.035  -3.915   3.702
  561    HH2  TRP  77           HH2      TRP  77  11.831  -5.541   3.999
  562    H    CYS  78           HN       CYS  78   6.621  -6.095   7.211
  563    HA   CYS  78           HA       CYS  78   5.926  -7.467   9.730
  564   1HB   CYS  78          HB2       CYS  78   4.383  -7.533   7.616
  565   2HB   CYS  78          HB1       CYS  78   5.559  -8.687   7.011
  566    H    TYR  79           HN       TYR  79   7.581  -8.523  10.613
  567    HA   TYR  79           HA       TYR  79  10.127  -8.584   9.533
  568   1HB   TYR  79          HB2       TYR  79   8.900 -10.209  11.748
  569   2HB   TYR  79          HB1       TYR  79  10.608 -10.308  11.338
  570    HD1  TYR  79           HD1      TYR  79  11.910  -8.063  11.320
  571    HD2  TYR  79           HD2      TYR  79   8.180  -8.623  13.284
  572    HE1  TYR  79           HE1      TYR  79  12.385  -6.128  12.758
  573    HE2  TYR  79           HE2      TYR  79   8.642  -6.686  14.727
  574    HH   TYR  79           HH       TYR  79  10.734  -5.478  15.560
  575    H    VAL  80           HN       VAL  80   8.134 -11.516  10.036
  576    HA   VAL  80           HA       VAL  80   9.961 -13.178   8.678
  577    HB   VAL  80           HB       VAL  80   8.112 -14.877   8.678
  578   1HG1  VAL  80          HG11      VAL  80   9.690 -14.786  10.496
  579   2HG1  VAL  80          HG12      VAL  80   8.080 -15.097  11.146
  580   3HG1  VAL  80          HG13      VAL  80   8.784 -13.484  11.266
  581   1HG2  VAL  80          HG21      VAL  80   6.225 -13.312   8.531
  582   2HG2  VAL  80          HG22      VAL  80   6.601 -12.719  10.149
  583   3HG2  VAL  80          HG23      VAL  80   6.081 -14.388   9.920
  584    H    ASP  81           HN       ASP  81   7.503 -11.129   7.483
  585    HA   ASP  81           HA       ASP  81   7.227 -12.552   4.958
  586   1HB   ASP  81          HB2       ASP  81   6.107  -9.858   5.762
  587   2HB   ASP  81          HB1       ASP  81   5.653 -10.792   4.346
  588    H    GLU  82           HN       GLU  82   8.767  -9.746   6.326
  589    HA   GLU  82           HA       GLU  82  10.256  -8.228   5.588
  590   1HB   GLU  82          HB2       GLU  82  10.741 -10.271   3.413
  591   2HB   GLU  82          HB1       GLU  82  11.714  -8.823   3.645
  592   1HG   GLU  82          HG2       GLU  82  12.169  -9.637   5.981
  593   2HG   GLU  82          HG1       GLU  82  11.417 -11.160   5.509
  594    H    VAL  83           HN       VAL  83   7.482  -8.201   4.779
  595    HA   VAL  83           HA       VAL  83   7.672  -6.628   2.306
  596    HB   VAL  83           HB       VAL  83   5.292  -6.953   1.995
  597   1HG1  VAL  83          HG11      VAL  83   6.702  -9.554   2.565
  598   2HG1  VAL  83          HG12      VAL  83   6.760  -8.638   1.059
  599   3HG1  VAL  83          HG13      VAL  83   5.245  -9.371   1.588
  600   1HG2  VAL  83          HG21      VAL  83   4.582  -7.001   4.325
  601   2HG2  VAL  83          HG22      VAL  83   5.356  -8.571   4.541
  602   3HG2  VAL  83          HG23      VAL  83   3.972  -8.411   3.458
  603    H    MET  84           HN       MET  84   6.739  -4.591   2.224
  604    HA   MET  84           HA       MET  84   5.896  -3.462   4.809
  605   1HB   MET  84          HB2       MET  84   8.096  -2.597   4.018
  606   2HB   MET  84          HB1       MET  84   7.307  -2.008   2.563
  607   1HG   MET  84          HG2       MET  84   6.002  -0.451   3.814
  608   2HG   MET  84          HG1       MET  84   6.554  -1.140   5.340
  609   1HE   MET  84          HE1       MET  84   9.330   1.143   2.441
  610   2HE   MET  84          HE2       MET  84   7.628   0.819   2.110
  611   3HE   MET  84          HE3       MET  84   8.787  -0.511   2.154
  612    H    PHE  85           HN       PHE  85   3.889  -2.711   4.850
  613    HA   PHE  85           HA       PHE  85   2.567  -2.146   2.284
  614   1HB   PHE  85          HB2       PHE  85   0.475  -3.132   3.349
  615   2HB   PHE  85          HB1       PHE  85   1.729  -4.275   2.885
  616    HD1  PHE  85           HD1      PHE  85  -0.008  -2.688   5.686
  617    HD2  PHE  85           HD2      PHE  85   2.975  -5.501   4.546
  618    HE1  PHE  85           HE1      PHE  85  -0.003  -3.604   7.968
  619    HE2  PHE  85           HE2      PHE  85   2.987  -6.421   6.828
  620    HZ   PHE  85           HZ       PHE  85   1.496  -5.472   8.542
  621    H    ASP  86           HN       ASP  86   0.468  -0.934   2.615
  622    HA   ASP  86           HA       ASP  86   1.112   1.398   4.209
  623   1HB   ASP  86          HB2       ASP  86   0.337   1.817   1.979
  624   2HB   ASP  86          HB1       ASP  86  -1.089   0.815   2.226
  625    H    LEU  87           HN       LEU  87   0.124   2.078   5.990
  626    HA   LEU  87           HA       LEU  87  -2.317   0.715   6.893
  627   1HB   LEU  87          HB2       LEU  87   0.217   1.158   8.455
  628   2HB   LEU  87          HB1       LEU  87  -1.328   0.946   9.252
  629    HG   LEU  87           HG       LEU  87  -0.007  -1.079   7.442
  630   1HD1  LEU  87          HD11      LEU  87   1.163  -0.808   9.570
  631   2HD1  LEU  87          HD12      LEU  87   0.329  -2.359   9.493
  632   3HD1  LEU  87          HD13      LEU  87  -0.355  -1.037  10.439
  633   1HD2  LEU  87          HD21      LEU  87  -1.780  -2.580   8.224
  634   2HD2  LEU  87          HD22      LEU  87  -2.440  -1.200   7.347
  635   3HD2  LEU  87          HD23      LEU  87  -2.518  -1.244   9.108
  636    H    SER  88           HN       SER  88  -1.557   3.386   5.675
  637    HA   SER  88           HA       SER  88  -1.523   5.407   7.595
  638   1HB   SER  88          HB2       SER  88  -0.952   5.805   5.254
  639   2HB   SER  88          HB1       SER  88  -2.620   5.494   4.776
  640    HG   SER  88           HG       SER  88  -2.995   7.510   5.160
  641    H    ASP  89           HN       ASP  89  -4.236   3.634   6.244
  642    HA   ASP  89           HA       ASP  89  -6.137   5.460   7.521
  643   1HB   ASP  89          HB2       ASP  89  -6.718   3.023   5.824
  644   2HB   ASP  89          HB1       ASP  89  -7.864   4.268   6.309
  645    H    ARG  90           HN       ARG  90  -4.306   3.103   8.620
  646    HA   ARG  90           HA       ARG  90  -6.319   2.158  10.542
  647   1HB   ARG  90          HB2       ARG  90  -4.377   0.432   8.993
  648   2HB   ARG  90          HB1       ARG  90  -5.218  -0.116  10.434
  649   1HG   ARG  90          HG2       ARG  90  -7.347   0.109   9.332
  650   2HG   ARG  90          HG1       ARG  90  -6.571   0.807   7.908
  651   1HD   ARG  90          HD2       ARG  90  -7.144  -1.598   7.654
  652   2HD   ARG  90          HD1       ARG  90  -5.429  -1.250   7.447
  653    HE   ARG  90           HE       ARG  90  -5.320  -1.970   9.925
  654   1HH1  ARG  90          HH11      ARG  90  -7.494  -3.328   7.538
  655   2HH1  ARG  90          HH12      ARG  90  -7.515  -4.903   8.273
  656   1HH2  ARG  90          HH21      ARG  90  -5.354  -4.021  10.892
  657   2HH2  ARG  90          HH22      ARG  90  -6.316  -5.293  10.196
  658    H    MET  91           HN       MET  91  -3.942   4.068  10.435
  659    HA   MET  91           HA       MET  91  -1.751   2.755  11.697
  660   1HB   MET  91          HB2       MET  91  -0.704   4.955  11.769
  661   2HB   MET  91          HB1       MET  91  -1.404   4.642  10.188
  662   1HG   MET  91          HG2       MET  91  -3.284   6.060  10.691
  663   2HG   MET  91          HG1       MET  91  -2.700   6.300  12.337
  664   1HE   MET  91          HE1       MET  91   0.585   8.338  11.754
  665   2HE   MET  91          HE2       MET  91   0.408   6.592  11.929
  666   3HE   MET  91          HE3       MET  91  -0.524   7.680  12.957
  667    H    THR  92           HN       THR  92  -0.703   3.704  13.644
  668    HA   THR  92           HA       THR  92  -2.596   3.633  15.845
  669    HB   THR  92           HB       THR  92   0.407   3.892  16.016
  670    HG1  THR  92           HG1      THR  92   0.057   2.087  14.759
  671   1HG2  THR  92          HG21      THR  92   0.099   2.736  18.150
  672   2HG2  THR  92          HG22      THR  92  -1.641   2.671  17.869
  673   3HG2  THR  92          HG23      THR  92  -0.841   4.227  18.096
  674    HA   PRO  93           HA       PRO  93  -2.409   8.114  16.334
  675   1HB   PRO  93          HB2       PRO  93  -3.759   8.203  18.697
  676   2HB   PRO  93          HB1       PRO  93  -4.563   8.037  17.133
  677   1HG   PRO  93          HG2       PRO  93  -3.914   5.942  19.165
  678   2HG   PRO  93          HG1       PRO  93  -5.377   6.136  18.183
  679   1HD   PRO  93          HD2       PRO  93  -3.422   4.347  17.587
  680   2HD   PRO  93          HD1       PRO  93  -4.434   5.119  16.350
  681    H    HIS  94           HN       HIS  94  -0.594   9.073  17.027
  682    HA   HIS  94           HA       HIS  94   1.186   7.892  18.853
  683   1HB   HIS  94          HB2       HIS  94   2.473   9.944  18.748
  684   2HB   HIS  94          HB1       HIS  94   1.895   9.528  17.143
  685    HD1  HIS  94           HD1      HIS  94   0.300  11.169  15.994
  686    HD2  HIS  94           HD2      HIS  94   1.362  12.289  19.859
  687    HE1  HIS  94           HE1      HIS  94  -0.455  13.558  16.243
  688    HE2  HIS  94           HE2      HIS  94   0.141  14.196  18.612
  689    H    ASN  95           HN       ASN  95   1.728   8.370  20.986
  690    HA   ASN  95           HA       ASN  95  -0.611   9.134  22.528
  691   1HB   ASN  95          HB2       ASN  95   0.513   8.157  24.438
  692   2HB   ASN  95          HB1       ASN  95   0.600   7.052  23.073
  693   1HD2  ASN  95          HD21      ASN  95   2.248   7.165  25.434
  694   2HD2  ASN  95          HD22      ASN  95   3.872   7.391  24.893
  695    H    GLY  96           HN       GLY  96   2.624  10.331  21.921
  696   1HA   GLY  96          HA2       GLY  96   1.886  12.870  23.089
  697   2HA   GLY  96          HA1       GLY  96   3.155  12.015  23.954
  698    HA   PRO  97           HA       PRO  97   5.135  14.520  20.569
  699   1HB   PRO  97          HB2       PRO  97   6.849  15.881  22.147
  700   2HB   PRO  97          HB1       PRO  97   5.192  16.428  21.865
  701   1HG   PRO  97          HG2       PRO  97   6.321  14.937  24.204
  702   2HG   PRO  97          HG1       PRO  97   5.201  16.312  24.190
  703   1HD   PRO  97          HD2       PRO  97   4.383  13.744  24.523
  704   2HD   PRO  97          HD1       PRO  97   3.378  14.983  23.744
  705    H    ILE  98           HN       ILE  98   7.030  13.955  19.604
  706    HA   ILE  98           HA       ILE  98   8.776  12.094  21.077
  707    HB   ILE  98           HB       ILE  98   8.094  12.088  18.129
  708   1HG1  ILE  98          HG12      ILE  98   7.485  10.098  20.328
  709   2HG1  ILE  98          HG11      ILE  98   6.322  11.179  19.569
  710   1HG2  ILE  98          HG21      ILE  98  10.427  11.483  18.475
  711   2HG2  ILE  98          HG22      ILE  98   9.486  10.075  17.986
  712   3HG2  ILE  98          HG23      ILE  98   9.952  10.280  19.674
  713   1HD1  ILE  98          HD11      ILE  98   7.821   8.957  18.205
  714   2HD1  ILE  98          HD12      ILE  98   6.658  10.039  17.438
  715   3HD1  ILE  98          HD13      ILE  98   6.129   8.927  18.700
  716    HA   PRO  99           HA       PRO  99  11.940  15.191  20.352
  717   1HB   PRO  99          HB2       PRO  99  13.721  12.891  20.932
  718   2HB   PRO  99          HB1       PRO  99  13.656  14.483  21.695
  719   1HG   PRO  99          HG2       PRO  99  12.738  12.320  22.956
  720   2HG   PRO  99          HG1       PRO  99  11.916  13.886  23.103
  721   1HD   PRO  99          HD2       PRO  99  11.177  11.500  21.452
  722   2HD   PRO  99          HD1       PRO  99  10.131  12.602  22.371
  723    H    ARG 100           HN       ARG 100  12.135  15.642  18.260
  724    HA   ARG 100           HA       ARG 100  12.610  13.623  16.268
  725   1HB   ARG 100          HB2       ARG 100  11.163  15.635  15.930
  726   2HB   ARG 100          HB1       ARG 100  12.598  16.640  16.008
  727   1HG   ARG 100          HG2       ARG 100  12.384  14.459  13.973
  728   2HG   ARG 100          HG1       ARG 100  11.601  16.016  13.713
  729   1HD   ARG 100          HD2       ARG 100  14.539  15.535  14.191
  730   2HD   ARG 100          HD1       ARG 100  13.785  15.984  12.662
  731    HE   ARG 100           HE       ARG 100  13.065  17.982  14.388
  732   1HH1  ARG 100          HH11      ARG 100  16.082  16.615  13.244
  733   2HH1  ARG 100          HH12      ARG 100  17.007  18.055  13.558
  734   1HH2  ARG 100          HH21      ARG 100  14.260  19.911  14.724
  735   2HH2  ARG 100          HH22      ARG 100  15.962  19.945  14.359
  736    H    TYR 101           HN       TYR 101  14.581  12.760  16.061
  737    HA   TYR 101           HA       TYR 101  16.920  14.473  16.497
  738   1HB   TYR 101          HB2       TYR 101  16.667  11.468  16.321
  739   2HB   TYR 101          HB1       TYR 101  18.202  12.316  16.469
  740    HD1  TYR 101           HD1      TYR 101  18.419  13.916  18.530
  741    HD2  TYR 101           HD2      TYR 101  15.554  10.785  18.235
  742    HE1  TYR 101           HE1      TYR 101  18.195  13.897  20.980
  743    HE2  TYR 101           HE2      TYR 101  15.321  10.760  20.681
  744    HH   TYR 101           HH       TYR 101  16.622  11.392  22.659
  745    H    VAL 102           HN       VAL 102  15.160  12.865  14.009
  746    HA   VAL 102           HA       VAL 102  17.350  13.180  12.106
  747    HB   VAL 102           HB       VAL 102  15.656  12.102  10.495
  748   1HG1  VAL 102          HG11      VAL 102  17.599  10.946  11.413
  749   2HG1  VAL 102          HG12      VAL 102  16.212   9.863  11.303
  750   3HG1  VAL 102          HG13      VAL 102  16.681  10.539  12.863
  751   1HG2  VAL 102          HG21      VAL 102  13.919  10.737  11.561
  752   2HG2  VAL 102          HG22      VAL 102  13.648  12.456  11.848
  753   3HG2  VAL 102          HG23      VAL 102  14.322  11.444  13.126
  Start of MODEL   15
    1   1H    MET   1          HT1       MET   1   5.252   0.972   0.542
    2   2H    MET   1          HT2       MET   1   4.294   2.165   1.275
    3   3H    MET   1          HT3       MET   1   4.537   2.184  -0.406
    4    HA   MET   1           HA       MET   1   3.102   0.102   1.129
    5   1HB   MET   1          HB2       MET   1   1.106   0.927  -0.123
    6   2HB   MET   1          HB1       MET   1   1.759   2.096   1.015
    7   1HG   MET   1          HG2       MET   1   2.864   3.265  -0.824
    8   2HG   MET   1          HG1       MET   1   2.198   2.094  -1.962
    9   1HE   MET   1          HE1       MET   1   1.249   4.176  -3.368
   10   2HE   MET   1          HE2       MET   1   1.884   5.295  -2.162
   11   3HE   MET   1          HE3       MET   1   0.201   5.413  -2.676
   12    H    THR   2           HN       THR   2   3.665  -1.762   0.261
   13    HA   THR   2           HA       THR   2   3.814  -1.950  -2.672
   14    HB   THR   2           HB       THR   2   4.966  -3.863  -0.632
   15    HG1  THR   2           HG1      THR   2   6.159  -1.732  -2.121
   16   1HG2  THR   2          HG21      THR   2   4.501  -4.896  -2.797
   17   2HG2  THR   2          HG22      THR   2   6.239  -4.731  -2.547
   18   3HG2  THR   2          HG23      THR   2   5.391  -3.611  -3.614
   19    H    MET   3           HN       MET   3   3.054  -4.133   0.052
   20    HA   MET   3           HA       MET   3   0.492  -4.801  -1.090
   21   1HB   MET   3          HB2       MET   3   2.031  -6.209  -2.414
   22   2HB   MET   3          HB1       MET   3   2.675  -6.893  -0.929
   23   1HG   MET   3          HG2       MET   3   0.468  -7.824  -0.413
   24   2HG   MET   3          HG1       MET   3  -0.152  -7.162  -1.924
   25   1HE   MET   3          HE1       MET   3  -0.047 -11.011  -2.643
   26   2HE   MET   3          HE2       MET   3  -1.049  -9.560  -2.610
   27   3HE   MET   3          HE3       MET   3  -0.427 -10.236  -1.105
   28    H    GLY   4           HN       GLY   4  -0.899  -5.527   0.446
   29   1HA   GLY   4          HA2       GLY   4   0.045  -5.732   3.179
   30   2HA   GLY   4          HA1       GLY   4  -1.623  -5.867   2.632
   31    H    CYS   5           HN       CYS   5  -1.144  -7.649   4.448
   32    HA   CYS   5           HA       CYS   5  -1.056 -10.134   2.967
   33   1HB   CYS   5          HB2       CYS   5   0.667 -11.172   4.292
   34   2HB   CYS   5          HB1       CYS   5   1.316  -9.695   3.592
   35    H    ARG   6           HN       ARG   6  -1.586 -12.021   4.478
   36    HA   ARG   6           HA       ARG   6  -4.036 -11.472   5.704
   37   1HB   ARG   6          HB2       ARG   6  -4.020 -13.792   6.442
   38   2HB   ARG   6          HB1       ARG   6  -3.446 -13.667   4.786
   39   1HG   ARG   6          HG2       ARG   6  -1.099 -13.706   5.773
   40   2HG   ARG   6          HG1       ARG   6  -1.870 -14.226   7.272
   41   1HD   ARG   6          HD2       ARG   6  -2.059 -15.615   4.602
   42   2HD   ARG   6          HD1       ARG   6  -1.078 -16.134   5.970
   43    HE   ARG   6           HE       ARG   6  -3.417 -16.201   7.127
   44   1HH1  ARG   6          HH11      ARG   6  -2.637 -17.132   3.834
   45   2HH1  ARG   6          HH12      ARG   6  -3.892 -18.329   3.747
   46   1HH2  ARG   6          HH21      ARG   6  -5.064 -17.808   6.998
   47   2HH2  ARG   6          HH22      ARG   6  -5.271 -18.699   5.516
   48    H    HIS   7           HN       HIS   7  -0.834 -11.422   7.024
   49    HA   HIS   7           HA       HIS   7  -1.433 -11.675   9.759
   50   1HB   HIS   7          HB2       HIS   7   0.784 -10.123   8.413
   51   2HB   HIS   7          HB1       HIS   7   0.703 -10.456  10.138
   52    HD2  HIS   7           HD2      HIS   7   0.142 -13.592  10.190
   53    HE1  HIS   7           HE1      HIS   7   3.472 -13.843   7.590
   54    HE2  HIS   7           HE2      HIS   7   1.817 -15.170   8.983
   55    H    VAL   8           HN       VAL   8  -1.944  -9.067   7.541
   56    HA   VAL   8           HA       VAL   8  -1.909  -6.919   9.376
   57    HB   VAL   8           HB       VAL   8  -1.987  -6.958   6.712
   58   1HG1  VAL   8          HG11      VAL   8  -4.300  -7.778   6.592
   59   2HG1  VAL   8          HG12      VAL   8  -4.105  -6.196   5.837
   60   3HG1  VAL   8          HG13      VAL   8  -4.837  -6.324   7.437
   61   1HG2  VAL   8          HG21      VAL   8  -1.412  -5.036   8.068
   62   2HG2  VAL   8          HG22      VAL   8  -3.117  -4.749   8.416
   63   3HG2  VAL   8          HG23      VAL   8  -2.511  -4.567   6.770
   64    H    ALA   9           HN       ALA   9  -4.322  -9.307   8.590
   65    HA   ALA   9           HA       ALA   9  -6.513  -7.926   9.813
   66   1HB   ALA   9          HB1       ALA   9  -7.723  -9.998   9.566
   67   2HB   ALA   9          HB2       ALA   9  -6.225 -10.874   9.254
   68   3HB   ALA   9          HB3       ALA   9  -6.805  -9.678   8.094
   69    H    GLY  10           HN       GLY  10  -3.763  -9.100  11.127
   70   1HA   GLY  10          HA2       GLY  10  -5.096  -9.943  13.621
   71   2HA   GLY  10          HA1       GLY  10  -3.500 -10.486  13.123
   72    H    ILE  11           HN       ILE  11  -3.984  -7.214  12.424
   73    HA   ILE  11           HA       ILE  11  -2.448  -6.465  14.810
   74    HB   ILE  11           HB       ILE  11  -1.960  -4.343  13.664
   75   1HG1  ILE  11          HG12      ILE  11  -3.441  -5.599  11.343
   76   2HG1  ILE  11          HG11      ILE  11  -3.979  -4.209  12.276
   77   1HG2  ILE  11          HG21      ILE  11  -1.286  -6.803  12.056
   78   2HG2  ILE  11          HG22      ILE  11  -0.412  -6.202  13.466
   79   3HG2  ILE  11          HG23      ILE  11  -0.439  -5.258  11.977
   80   1HD1  ILE  11          HD11      ILE  11  -1.475  -4.289  10.615
   81   2HD1  ILE  11          HD12      ILE  11  -2.163  -2.884  11.433
   82   3HD1  ILE  11          HD13      ILE  11  -3.022  -3.632  10.083
   83    H    ARG  12           HN       ARG  12  -3.019  -4.598  16.009
   84    HA   ARG  12           HA       ARG  12  -5.829  -3.794  15.745
   85   1HB   ARG  12          HB2       ARG  12  -6.009  -3.938  18.244
   86   2HB   ARG  12          HB1       ARG  12  -5.847  -5.491  17.435
   87   1HG   ARG  12          HG2       ARG  12  -3.359  -5.311  17.941
   88   2HG   ARG  12          HG1       ARG  12  -3.796  -3.997  19.034
   89   1HD   ARG  12          HD2       ARG  12  -3.631  -6.086  20.251
   90   2HD   ARG  12          HD1       ARG  12  -5.300  -5.517  20.237
   91    HE   ARG  12           HE       ARG  12  -5.648  -7.170  18.390
   92   1HH1  ARG  12          HH11      ARG  12  -3.065  -7.619  20.725
   93   2HH1  ARG  12          HH12      ARG  12  -3.049  -9.344  20.550
   94   1HH2  ARG  12          HH21      ARG  12  -5.627  -9.452  18.185
   95   2HH2  ARG  12          HH22      ARG  12  -4.483 -10.383  19.115
   96    H    THR  13           HN       THR  13  -6.328  -1.755  16.788
   97    HA   THR  13           HA       THR  13  -4.181   0.138  16.675
   98    HB   THR  13           HB       THR  13  -6.987   0.513  17.754
   99    HG1  THR  13           HG1      THR  13  -7.553   0.525  15.713
  100   1HG2  THR  13          HG21      THR  13  -5.423   2.265  18.482
  101   2HG2  THR  13          HG22      THR  13  -6.592   2.894  17.322
  102   3HG2  THR  13          HG23      THR  13  -4.945   2.534  16.806
  103    H    VAL  14           HN       VAL  14  -2.673   0.117  18.170
  104    HA   VAL  14           HA       VAL  14  -3.324  -0.874  20.841
  105    HB   VAL  14           HB       VAL  14  -0.846  -1.181  21.045
  106   1HG1  VAL  14          HG11      VAL  14  -0.737  -3.109  19.549
  107   2HG1  VAL  14          HG12      VAL  14  -2.163  -2.522  18.692
  108   3HG1  VAL  14          HG13      VAL  14  -2.291  -3.020  20.379
  109   1HG2  VAL  14          HG21      VAL  14  -0.869  -0.407  18.127
  110   2HG2  VAL  14          HG22      VAL  14   0.515  -1.047  19.014
  111   3HG2  VAL  14          HG23      VAL  14  -0.152   0.531  19.437
  112    H    THR  15           HN       THR  15  -1.733   0.052  22.568
  113    HA   THR  15           HA       THR  15  -1.856   2.992  22.383
  114    HB   THR  15           HB       THR  15  -1.722   1.272  24.872
  115    HG1  THR  15           HG1      THR  15  -3.781   1.784  23.265
  116   1HG2  THR  15          HG21      THR  15  -2.261   4.226  24.524
  117   2HG2  THR  15          HG22      THR  15  -0.787   3.515  25.181
  118   3HG2  THR  15          HG23      THR  15  -2.312   3.342  26.049
  119    HA   PRO  16           HA       PRO  16   2.610   2.854  22.213
  120   1HB   PRO  16          HB2       PRO  16   2.391   5.694  22.990
  121   2HB   PRO  16          HB1       PRO  16   3.128   4.975  21.555
  122   1HG   PRO  16          HG2       PRO  16   0.816   6.317  21.409
  123   2HG   PRO  16          HG1       PRO  16   1.125   4.887  20.406
  124   1HD   PRO  16          HD2       PRO  16  -0.508   5.137  22.902
  125   2HD   PRO  16          HD1       PRO  16  -0.846   4.218  21.419
  126    H    SER  17           HN       SER  17   3.812   2.074  23.806
  127    HA   SER  17           HA       SER  17   3.272   2.355  26.548
  128   1HB   SER  17          HB2       SER  17   5.967   1.668  25.368
  129   2HB   SER  17          HB1       SER  17   5.284   1.126  26.901
  130    HG   SER  17           HG       SER  17   3.564   0.176  25.430
  131    H    ALA  18           HN       ALA  18   5.159   4.245  24.336
  132    HA   ALA  18           HA       ALA  18   5.487   6.369  26.227
  133   1HB   ALA  18          HB1       ALA  18   7.376   5.012  26.913
  134   2HB   ALA  18          HB2       ALA  18   7.956   6.451  26.073
  135   3HB   ALA  18          HB3       ALA  18   7.933   4.894  25.244
  136    H    LEU  19           HN       LEU  19   6.820   8.184  25.114
  137    HA   LEU  19           HA       LEU  19   5.683   8.713  22.578
  138   1HB   LEU  19          HB2       LEU  19   7.897  10.048  24.127
  139   2HB   LEU  19          HB1       LEU  19   7.392  10.618  22.551
  140    HG   LEU  19           HG       LEU  19   5.083  10.943  23.502
  141   1HD1  LEU  19          HD11      LEU  19   5.251   9.451  25.419
  142   2HD1  LEU  19          HD12      LEU  19   4.861  11.095  25.928
  143   3HD1  LEU  19          HD13      LEU  19   6.502  10.478  26.120
  144   1HD2  LEU  19          HD21      LEU  19   5.662  13.023  24.646
  145   2HD2  LEU  19          HD22      LEU  19   6.626  12.795  23.187
  146   3HD2  LEU  19          HD23      LEU  19   7.338  12.488  24.771
  147    H    GLY  20           HN       GLY  20   9.059   8.141  23.517
  148   1HA   GLY  20          HA2       GLY  20   9.586   7.199  20.783
  149   2HA   GLY  20          HA1       GLY  20  10.813   7.748  21.918
  150    H    CYS  21           HN       CYS  21  12.053   5.908  21.902
  151    HA   CYS  21           HA       CYS  21  10.914   3.309  22.257
  152   1HB   CYS  21          HB2       CYS  21  13.017   3.593  21.042
  153   2HB   CYS  21          HB1       CYS  21  13.782   4.248  22.486
  154    HG   CYS  21           HG       CYS  21  14.860   1.805  22.455
  155    H    GLU  22           HN       GLU  22  10.253   2.454  24.083
  156    HA   GLU  22           HA       GLU  22  10.312   3.664  26.575
  157   1HB   GLU  22          HB2       GLU  22   8.723   1.925  26.040
  158   2HB   GLU  22          HB1       GLU  22  10.009   0.752  25.821
  159   1HG   GLU  22          HG2       GLU  22   9.701   2.058  28.478
  160   2HG   GLU  22          HG1       GLU  22   8.556   0.806  28.004
  161    H    GLU  23           HN       GLU  23  12.478   1.201  25.243
  162    HA   GLU  23           HA       GLU  23  14.021   0.797  27.540
  163   1HB   GLU  23          HB2       GLU  23  14.079  -0.708  25.613
  164   2HB   GLU  23          HB1       GLU  23  14.846   0.547  24.650
  165   1HG   GLU  23          HG2       GLU  23  16.799   0.490  26.079
  166   2HG   GLU  23          HG1       GLU  23  16.026  -0.708  27.118
  167    H    CYS  24           HN       CYS  24  14.440   3.058  24.846
  168    HA   CYS  24           HA       CYS  24  16.905   4.091  25.720
  169   1HB   CYS  24          HB2       CYS  24  14.760   5.317  23.980
  170   2HB   CYS  24          HB1       CYS  24  16.356   6.020  24.219
  171    HG   CYS  24           HG       CYS  24  17.253   4.873  22.113
  172    H    LEU  25           HN       LEU  25  13.576   4.976  26.446
  173    HA   LEU  25           HA       LEU  25  14.233   7.457  27.675
  174   1HB   LEU  25          HB2       LEU  25  11.747   5.767  27.723
  175   2HB   LEU  25          HB1       LEU  25  11.866   7.318  28.534
  176    HG   LEU  25           HG       LEU  25  12.234   6.895  25.569
  177   1HD1  LEU  25          HD11      LEU  25   9.906   8.038  27.105
  178   2HD1  LEU  25          HD12      LEU  25   9.928   6.496  26.249
  179   3HD1  LEU  25          HD13      LEU  25  10.069   8.007  25.350
  180   1HD2  LEU  25          HD21      LEU  25  13.501   8.786  26.437
  181   2HD2  LEU  25          HD22      LEU  25  12.049   9.411  27.220
  182   3HD2  LEU  25          HD23      LEU  25  12.139   9.336  25.461
  183    H    LYS  26           HN       LYS  26  14.417   4.228  28.817
  184    HA   LYS  26           HA       LYS  26  13.932   4.967  31.586
  185   1HB   LYS  26          HB2       LYS  26  14.149   2.665  32.105
  186   2HB   LYS  26          HB1       LYS  26  13.273   2.741  30.584
  187   1HG   LYS  26          HG2       LYS  26  15.702   2.483  29.581
  188   2HG   LYS  26          HG1       LYS  26  16.008   1.745  31.154
  189   1HD   LYS  26          HD2       LYS  26  13.810   0.947  29.259
  190   2HD   LYS  26          HD1       LYS  26  15.349   0.102  29.432
  191   1HE   LYS  26          HE2       LYS  26  14.825  -0.589  31.626
  192   2HE   LYS  26          HE1       LYS  26  13.494   0.560  31.756
  193   1HZ   LYS  26          HZ1       LYS  26  12.289  -0.702  30.078
  194   2HZ   LYS  26          HZ2       LYS  26  12.674  -1.674  31.415
  195   3HZ   LYS  26          HZ3       LYS  26  13.563  -1.822  29.977
  196    H    ILE  27           HN       ILE  27  16.551   5.016  29.455
  197    HA   ILE  27           HA       ILE  27  18.424   5.114  31.726
  198    HB   ILE  27           HB       ILE  27  20.193   4.255  30.175
  199   1HG1  ILE  27          HG12      ILE  27  17.808   3.533  28.454
  200   2HG1  ILE  27          HG11      ILE  27  19.035   4.731  28.056
  201   1HG2  ILE  27          HG21      ILE  27  19.499   1.896  30.382
  202   2HG2  ILE  27          HG22      ILE  27  17.869   2.435  30.792
  203   3HG2  ILE  27          HG23      ILE  27  19.221   2.821  31.857
  204   1HD1  ILE  27          HD11      ILE  27  20.726   2.981  27.978
  205   2HD1  ILE  27          HD12      ILE  27  19.399   2.646  26.865
  206   3HD1  ILE  27          HD13      ILE  27  19.505   1.780  28.397
  207    H    GLY  28           HN       GLY  28  17.088   6.799  29.148
  208   1HA   GLY  28          HA2       GLY  28  17.556   8.983  28.478
  209   2HA   GLY  28          HA1       GLY  28  19.033   8.929  29.434
  210    H    SER  29           HN       SER  29  17.808   6.924  26.802
  211    HA   SER  29           HA       SER  29  20.364   7.289  25.392
  212   1HB   SER  29          HB2       SER  29  19.808   4.978  26.142
  213   2HB   SER  29          HB1       SER  29  18.338   5.041  25.177
  214    HG   SER  29           HG       SER  29  20.992   5.283  24.162
  215    HA   PRO  30           HA       PRO  30  17.971   9.218  22.153
  216   1HB   PRO  30          HB2       PRO  30  19.788   9.213  20.179
  217   2HB   PRO  30          HB1       PRO  30  19.974  10.234  21.610
  218   1HG   PRO  30          HG2       PRO  30  21.283   7.627  20.959
  219   2HG   PRO  30          HG1       PRO  30  21.981   9.078  21.702
  220   1HD   PRO  30          HD2       PRO  30  21.161   6.857  23.106
  221   2HD   PRO  30          HD1       PRO  30  21.273   8.489  23.791
  222    H    TRP  31           HN       TRP  31  17.712   8.818  19.631
  223    HA   TRP  31           HA       TRP  31  17.754   6.071  18.813
  224   1HB   TRP  31          HB2       TRP  31  15.276   5.964  18.412
  225   2HB   TRP  31          HB1       TRP  31  15.738   5.922  20.109
  226    HD1  TRP  31           HD1      TRP  31  14.513   8.591  17.540
  227    HE1  TRP  31           HE1      TRP  31  13.010  10.254  18.804
  228    HE3  TRP  31           HE3      TRP  31  14.955   6.664  22.255
  229    HZ2  TRP  31           HZ2      TRP  31  12.118  10.681  21.444
  230    HZ3  TRP  31           HZ3      TRP  31  13.739   7.757  24.092
  231    HH2  TRP  31           HH2      TRP  31  12.350   9.724  23.693
  232    H    VAL  32           HN       VAL  32  16.969   5.808  16.604
  233    HA   VAL  32           HA       VAL  32  17.229   8.289  15.051
  234    HB   VAL  32           HB       VAL  32  17.328   5.431  14.058
  235   1HG1  VAL  32          HG11      VAL  32  16.639   7.020  12.352
  236   2HG1  VAL  32          HG12      VAL  32  18.263   6.419  12.021
  237   3HG1  VAL  32          HG13      VAL  32  18.041   8.030  12.705
  238   1HG2  VAL  32          HG21      VAL  32  19.606   7.333  14.597
  239   2HG2  VAL  32          HG22      VAL  32  19.743   5.727  13.884
  240   3HG2  VAL  32          HG23      VAL  32  19.206   5.908  15.554
  241    H    HIS  33           HN       HIS  33  15.430   5.233  14.747
  242    HA   HIS  33           HA       HIS  33  13.037   6.798  14.054
  243   1HB   HIS  33          HB2       HIS  33  13.970   4.178  12.861
  244   2HB   HIS  33          HB1       HIS  33  12.357   4.839  12.620
  245    HD1  HIS  33           HD1      HIS  33  15.232   4.477  10.766
  246    HD2  HIS  33           HD2      HIS  33  12.898   7.809  11.673
  247    HE1  HIS  33           HE1      HIS  33  15.724   6.169   8.969
  248    HE2  HIS  33           HE2      HIS  33  14.423   8.228   9.624
  249    H    LEU  34           HN       LEU  34  11.000   5.708  14.555
  250    HA   LEU  34           HA       LEU  34  11.291   3.918  16.887
  251   1HB   LEU  34          HB2       LEU  34   9.340   6.181  16.470
  252   2HB   LEU  34          HB1       LEU  34   9.131   4.957  17.704
  253    HG   LEU  34           HG       LEU  34  10.052   6.777  18.833
  254   1HD1  LEU  34          HD11      LEU  34  12.372   4.994  18.128
  255   2HD1  LEU  34          HD12      LEU  34  11.172   4.693  19.385
  256   3HD1  LEU  34          HD13      LEU  34  12.274   6.064  19.526
  257   1HD2  LEU  34          HD21      LEU  34  10.688   8.117  16.916
  258   2HD2  LEU  34          HD22      LEU  34  12.060   7.054  16.605
  259   3HD2  LEU  34          HD23      LEU  34  12.014   8.028  18.076
  260    H    ARG  35           HN       ARG  35  10.168   2.097  16.864
  261    HA   ARG  35           HA       ARG  35   8.096   1.769  14.793
  262   1HB   ARG  35          HB2       ARG  35   9.990  -0.297  15.936
  263   2HB   ARG  35          HB1       ARG  35   8.667  -0.654  14.835
  264   1HG   ARG  35          HG2       ARG  35   9.729   0.748  13.122
  265   2HG   ARG  35          HG1       ARG  35  11.070   1.060  14.229
  266   1HD   ARG  35          HD2       ARG  35  11.617  -1.298  14.280
  267   2HD   ARG  35          HD1       ARG  35  10.220  -1.672  13.273
  268    HE   ARG  35           HE       ARG  35  11.913   0.178  11.965
  269   1HH1  ARG  35          HH11      ARG  35  11.712  -3.219  12.827
  270   2HH1  ARG  35          HH12      ARG  35  12.718  -3.728  11.508
  271   1HH2  ARG  35          HH21      ARG  35  13.230  -0.522  10.224
  272   2HH2  ARG  35          HH22      ARG  35  13.575  -2.216  10.048
  273    H    ILE  36           HN       ILE  36   6.134   1.698  15.669
  274    HA   ILE  36           HA       ILE  36   5.831   0.615  18.381
  275    HB   ILE  36           HB       ILE  36   4.736   2.759  18.015
  276   1HG1  ILE  36          HG12      ILE  36   2.687   0.543  18.204
  277   2HG1  ILE  36          HG11      ILE  36   3.727   1.058  19.527
  278   1HG2  ILE  36          HG21      ILE  36   4.353   2.626  15.617
  279   2HG2  ILE  36          HG22      ILE  36   2.858   3.007  16.471
  280   3HG2  ILE  36          HG23      ILE  36   3.137   1.373  15.868
  281   1HD1  ILE  36          HD11      ILE  36   1.664   2.749  18.137
  282   2HD1  ILE  36          HD12      ILE  36   2.709   3.274  19.456
  283   3HD1  ILE  36          HD13      ILE  36   1.510   2.010  19.730
  284    H    CYS  37           HN       CYS  37   5.324  -1.343  18.651
  285    HA   CYS  37           HA       CYS  37   4.756  -3.103  16.488
  286   1HB   CYS  37          HB2       CYS  37   6.123  -3.701  18.434
  287   2HB   CYS  37          HB1       CYS  37   4.724  -3.510  19.479
  288    H    ARG  38           HN       ARG  38   2.813  -3.215  15.558
  289    HA   ARG  38           HA       ARG  38   0.485  -2.082  16.724
  290   1HB   ARG  38          HB2       ARG  38   0.920  -3.699  14.221
  291   2HB   ARG  38          HB1       ARG  38  -0.656  -3.075  14.685
  292   1HG   ARG  38          HG2       ARG  38   1.801  -1.425  14.140
  293   2HG   ARG  38          HG1       ARG  38   0.432  -1.644  13.050
  294   1HD   ARG  38          HD2       ARG  38   0.425  -0.291  15.744
  295   2HD   ARG  38          HD1       ARG  38   0.196   0.466  14.169
  296    HE   ARG  38           HE       ARG  38  -1.729  -1.376  15.441
  297   1HH1  ARG  38          HH11      ARG  38  -0.997   1.234  13.207
  298   2HH1  ARG  38          HH12      ARG  38  -2.671   1.639  12.966
  299   1HH2  ARG  38          HH21      ARG  38  -3.923  -0.833  15.082
  300   2HH2  ARG  38          HH22      ARG  38  -4.317   0.483  14.023
  301    H    THR  39           HN       THR  39   1.808  -4.865  17.630
  302    HA   THR  39           HA       THR  39  -0.714  -6.335  17.772
  303    HB   THR  39           HB       THR  39   1.926  -7.402  18.733
  304    HG1  THR  39           HG1      THR  39   1.051  -7.861  16.091
  305   1HG2  THR  39          HG21      THR  39   0.925  -9.549  18.083
  306   2HG2  THR  39          HG22      THR  39  -0.524  -8.706  17.535
  307   3HG2  THR  39          HG23      THR  39  -0.087  -8.690  19.244
  308    H    CYS  40           HN       CYS  40   1.917  -5.194  19.878
  309    HA   CYS  40           HA       CYS  40   0.138  -5.673  22.171
  310   1HB   CYS  40          HB2       CYS  40   2.096  -6.213  23.513
  311   2HB   CYS  40          HB1       CYS  40   2.053  -7.232  22.080
  312    H    GLY  41           HN       GLY  41   1.588  -3.286  20.372
  313   1HA   GLY  41          HA2       GLY  41   1.347  -1.011  20.701
  314   2HA   GLY  41          HA1       GLY  41   0.804  -1.335  22.335
  315    H    HIS  42           HN       HIS  42   3.794  -2.832  21.692
  316    HA   HIS  42           HA       HIS  42   4.999  -0.895  23.496
  317   1HB   HIS  42          HB2       HIS  42   5.189  -3.505  23.650
  318   2HB   HIS  42          HB1       HIS  42   6.471  -3.292  22.461
  319    HD1  HIS  42           HD1      HIS  42   8.702  -2.386  23.300
  320    HD2  HIS  42           HD2      HIS  42   5.717  -2.328  26.189
  321    HE1  HIS  42           HE1      HIS  42   9.861  -1.814  25.454
  322    HE2  HIS  42           HE2      HIS  42   8.061  -1.937  27.216
  323    H    VAL  43           HN       VAL  43   6.211   0.706  22.820
  324    HA   VAL  43           HA       VAL  43   7.013   0.831  20.030
  325    HB   VAL  43           HB       VAL  43   7.410   2.927  22.174
  326   1HG1  VAL  43          HG11      VAL  43   8.811   3.243  20.216
  327   2HG1  VAL  43          HG12      VAL  43   7.550   4.474  20.274
  328   3HG1  VAL  43          HG13      VAL  43   7.403   3.112  19.164
  329   1HG2  VAL  43          HG21      VAL  43   5.117   2.604  20.243
  330   2HG2  VAL  43          HG22      VAL  43   5.382   3.992  21.297
  331   3HG2  VAL  43          HG23      VAL  43   5.045   2.407  21.994
  332    H    GLY  44           HN       GLY  44   9.022   0.533  19.309
  333   1HA   GLY  44          HA2       GLY  44  11.239   0.597  21.249
  334   2HA   GLY  44          HA1       GLY  44  11.051  -0.781  20.170
  335    H    CYS  45           HN       CYS  45  13.325   0.947  20.289
  336    HA   CYS  45           HA       CYS  45  13.198   2.808  18.132
  337   1HB   CYS  45          HB2       CYS  45  15.740   2.749  18.386
  338   2HB   CYS  45          HB1       CYS  45  14.808   3.297  19.775
  339    HG   CYS  45           HG       CYS  45  16.759   1.834  20.920
  340    H    CYS  46           HN       CYS  46  13.979   2.649  16.095
  341    HA   CYS  46           HA       CYS  46  13.674   0.164  14.787
  342   1HB   CYS  46          HB2       CYS  46  13.187   2.426  13.836
  343   2HB   CYS  46          HB1       CYS  46  14.918   2.713  13.739
  344    HG   CYS  46           HG       CYS  46  15.072   1.875  11.334
  345    H    ASP  47           HN       ASP  47  15.413  -0.545  13.112
  346    HA   ASP  47           HA       ASP  47  17.682  -1.364  14.673
  347   1HB   ASP  47          HB2       ASP  47  18.247  -2.795  12.820
  348   2HB   ASP  47          HB1       ASP  47  16.511  -2.889  13.086
  349    H    ASP  48           HN       ASP  48  17.060   1.381  12.980
  350    HA   ASP  48           HA       ASP  48  19.627   1.955  11.883
  351   1HB   ASP  48          HB2       ASP  48  17.518   3.858  12.938
  352   2HB   ASP  48          HB1       ASP  48  18.906   4.315  11.961
  353    H    SER  49           HN       SER  49  18.321   1.828  15.036
  354    HA   SER  49           HA       SER  49  20.459   3.474  16.179
  355   1HB   SER  49          HB2       SER  49  18.050   2.275  17.568
  356   2HB   SER  49          HB1       SER  49  19.108   3.552  18.174
  357    HG   SER  49           HG       SER  49  18.236   4.354  15.833
  358    HA   PRO  50           HA       PRO  50  22.989   0.072  17.338
  359   1HB   PRO  50          HB2       PRO  50  23.577   0.860  19.958
  360   2HB   PRO  50          HB1       PRO  50  24.468   1.319  18.506
  361   1HG   PRO  50          HG2       PRO  50  22.374   2.821  20.000
  362   2HG   PRO  50          HG1       PRO  50  23.826   3.426  19.181
  363   1HD   PRO  50          HD2       PRO  50  21.408   3.715  18.087
  364   2HD   PRO  50          HD1       PRO  50  22.826   3.341  17.083
  365    H    HIS  51           HN       HIS  51  20.411   1.008  19.542
  366    HA   HIS  51           HA       HIS  51  20.427  -1.280  21.178
  367   1HB   HIS  51          HB2       HIS  51  18.295   0.706  20.451
  368   2HB   HIS  51          HB1       HIS  51  17.920  -0.689  21.450
  369    HD1  HIS  51           HD1      HIS  51  17.943  -0.175  23.824
  370    HD2  HIS  51           HD2      HIS  51  20.651   2.195  21.736
  371    HE1  HIS  51           HE1      HIS  51  18.903   1.409  25.530
  372    HE2  HIS  51           HE2      HIS  51  20.360   2.981  24.183
  373    H    LYS  52           HN       LYS  52  18.599  -0.545  18.220
  374    HA   LYS  52           HA       LYS  52  17.304  -1.806  16.839
  375   1HB   LYS  52          HB2       LYS  52  19.384  -3.891  17.524
  376   2HB   LYS  52          HB1       LYS  52  18.266  -3.983  16.169
  377   1HG   LYS  52          HG2       LYS  52  19.270  -1.823  15.347
  378   2HG   LYS  52          HG1       LYS  52  20.512  -2.032  16.580
  379   1HD   LYS  52          HD2       LYS  52  19.877  -3.985  14.373
  380   2HD   LYS  52          HD1       LYS  52  21.237  -2.863  14.392
  381   1HE   LYS  52          HE2       LYS  52  22.092  -3.965  16.416
  382   2HE   LYS  52          HE1       LYS  52  20.747  -5.104  16.351
  383   1HZ   LYS  52          HZ1       LYS  52  22.863  -4.771  14.292
  384   2HZ   LYS  52          HZ2       LYS  52  21.544  -5.831  14.173
  385   3HZ   LYS  52          HZ3       LYS  52  22.716  -6.070  15.375
  386    H    HIS  53           HN       HIS  53  16.270  -1.698  19.424
  387    HA   HIS  53           HA       HIS  53  15.719  -4.284  20.469
  388   1HB   HIS  53          HB2       HIS  53  15.613  -1.942  21.636
  389   2HB   HIS  53          HB1       HIS  53  13.957  -1.925  21.039
  390    HD1  HIS  53           HD1      HIS  53  15.956  -3.017  23.829
  391    HD2  HIS  53           HD2      HIS  53  12.441  -4.303  22.010
  392    HE1  HIS  53           HE1      HIS  53  14.836  -4.523  25.501
  393    HE2  HIS  53           HE2      HIS  53  12.799  -5.417  24.321
  394    H    ALA  54           HN       ALA  54  14.382  -2.448  17.919
  395    HA   ALA  54           HA       ALA  54  11.747  -3.434  17.887
  396   1HB   ALA  54          HB1       ALA  54  11.675  -2.691  15.584
  397   2HB   ALA  54          HB2       ALA  54  13.433  -2.563  15.548
  398   3HB   ALA  54          HB3       ALA  54  12.492  -1.493  16.587
  399    H    THR  55           HN       THR  55  14.744  -4.674  16.450
  400    HA   THR  55           HA       THR  55  13.391  -6.874  15.174
  401    HB   THR  55           HB       THR  55  15.737  -7.680  14.712
  402    HG1  THR  55           HG1      THR  55  17.406  -6.616  15.522
  403   1HG2  THR  55          HG21      THR  55  16.240  -5.905  13.091
  404   2HG2  THR  55          HG22      THR  55  15.087  -4.843  13.899
  405   3HG2  THR  55          HG23      THR  55  14.523  -6.307  13.094
  406    H    ARG  56           HN       ARG  56  15.414  -6.380  18.028
  407    HA   ARG  56           HA       ARG  56  15.612  -9.003  18.938
  408   1HB   ARG  56          HB2       ARG  56  15.299  -6.485  20.585
  409   2HB   ARG  56          HB1       ARG  56  15.849  -8.034  21.201
  410   1HG   ARG  56          HG2       ARG  56  17.808  -7.909  19.724
  411   2HG   ARG  56          HG1       ARG  56  17.260  -6.326  19.163
  412   1HD   ARG  56          HD2       ARG  56  17.363  -5.495  21.477
  413   2HD   ARG  56          HD1       ARG  56  17.968  -7.064  22.000
  414    HE   ARG  56           HE       ARG  56  19.595  -5.945  19.942
  415   1HH1  ARG  56          HH11      ARG  56  18.883  -5.759  23.373
  416   2HH1  ARG  56          HH12      ARG  56  20.452  -5.131  23.796
  417   1HH2  ARG  56          HH21      ARG  56  21.665  -5.122  20.499
  418   2HH2  ARG  56          HH22      ARG  56  22.035  -4.797  22.162
  419    H    HIS  57           HN       HIS  57  13.000  -6.680  19.233
  420    HA   HIS  57           HA       HIS  57  11.434  -8.012  21.132
  421   1HB   HIS  57          HB2       HIS  57  11.053  -5.674  20.481
  422   2HB   HIS  57          HB1       HIS  57  10.539  -6.199  18.881
  423    HD1  HIS  57           HD1      HIS  57   9.454  -6.451  22.509
  424    HD2  HIS  57           HD2      HIS  57   7.913  -6.858  18.664
  425    HE1  HIS  57           HE1      HIS  57   6.960  -6.779  22.767
  426    H    PHE  58           HN       PHE  58  11.429  -8.208  17.593
  427    HA   PHE  58           HA       PHE  58   9.208  -9.934  17.391
  428   1HB   PHE  58          HB2       PHE  58   9.919  -8.724  15.444
  429   2HB   PHE  58          HB1       PHE  58  11.527  -9.435  15.519
  430    HD1  PHE  58           HD1      PHE  58   8.021 -10.740  15.495
  431    HD2  PHE  58           HD2      PHE  58  11.933 -10.932  13.861
  432    HE1  PHE  58           HE1      PHE  58   7.299 -12.549  13.993
  433    HE2  PHE  58           HE2      PHE  58  11.223 -12.737  12.350
  434    HZ   PHE  58           HZ       PHE  58   8.902 -13.551  12.418
  435    H    HIS  59           HN       HIS  59  12.657 -10.508  17.756
  436    HA   HIS  59           HA       HIS  59  12.646 -13.288  17.345
  437   1HB   HIS  59          HB2       HIS  59  14.656 -11.727  17.474
  438   2HB   HIS  59          HB1       HIS  59  14.488 -11.801  19.223
  439    HD1  HIS  59           HD1      HIS  59  16.255 -13.341  16.541
  440    HD2  HIS  59           HD2      HIS  59  14.640 -14.678  20.133
  441    HE1  HIS  59           HE1      HIS  59  17.409 -15.522  17.037
  442    HE2  HIS  59           HE2      HIS  59  16.258 -16.408  19.099
  443    H    ALA  60           HN       ALA  60  11.808 -11.320  20.104
  444    HA   ALA  60           HA       ALA  60  11.833 -13.579  21.925
  445   1HB   ALA  60          HB1       ALA  60  12.632 -11.356  22.639
  446   2HB   ALA  60          HB2       ALA  60  11.333 -11.984  23.654
  447   3HB   ALA  60          HB3       ALA  60  10.990 -10.737  22.454
  448    H    THR  61           HN       THR  61   9.377 -11.200  20.873
  449    HA   THR  61           HA       THR  61   7.300 -12.752  22.163
  450    HB   THR  61           HB       THR  61   5.782 -10.938  21.280
  451    HG1  THR  61           HG1      THR  61   8.279  -9.778  20.518
  452   1HG2  THR  61          HG21      THR  61   6.720 -10.876  23.552
  453   2HG2  THR  61          HG22      THR  61   6.543  -9.258  22.872
  454   3HG2  THR  61          HG23      THR  61   8.135 -10.019  22.938
  455    H    GLY  62           HN       GLY  62   8.489 -12.247  18.924
  456   1HA   GLY  62          HA2       GLY  62   7.919 -13.364  16.977
  457   2HA   GLY  62          HA1       GLY  62   6.704 -14.253  17.886
  458    H    HIS  63           HN       HIS  63   7.077 -10.756  17.539
  459    HA   HIS  63           HA       HIS  63   4.383 -10.670  16.352
  460   1HB   HIS  63          HB2       HIS  63   5.903  -8.577  17.927
  461   2HB   HIS  63          HB1       HIS  63   4.386  -8.258  17.096
  462    HD2  HIS  63           HD2      HIS  63   3.545 -11.502  18.390
  463    HE1  HIS  63           HE1      HIS  63   3.021  -8.944  21.728
  464    HE2  HIS  63           HE2      HIS  63   2.755 -11.324  20.856
  465    HA   PRO  64           HA       PRO  64   7.127  -9.859  12.928
  466   1HB   PRO  64          HB2       PRO  64   5.516 -10.681  10.963
  467   2HB   PRO  64          HB1       PRO  64   6.229 -11.816  12.115
  468   1HG   PRO  64          HG2       PRO  64   3.463 -10.684  12.035
  469   2HG   PRO  64          HG1       PRO  64   3.987 -12.338  12.397
  470   1HD   PRO  64          HD2       PRO  64   3.334 -10.445  14.299
  471   2HD   PRO  64          HD1       PRO  64   4.369 -11.855  14.593
  472    H    ILE  65           HN       ILE  65   4.523  -7.941  13.752
  473    HA   ILE  65           HA       ILE  65   4.947  -6.288  11.355
  474    HB   ILE  65           HB       ILE  65   2.315  -6.689  12.782
  475   1HG1  ILE  65          HG12      ILE  65   3.261  -7.385   9.992
  476   2HG1  ILE  65          HG11      ILE  65   2.852  -8.520  11.274
  477   1HG2  ILE  65          HG21      ILE  65   1.379  -5.149  11.112
  478   2HG2  ILE  65          HG22      ILE  65   3.002  -4.844  10.493
  479   3HG2  ILE  65          HG23      ILE  65   2.579  -4.357  12.134
  480   1HD1  ILE  65          HD11      ILE  65   1.086  -8.398   9.627
  481   2HD1  ILE  65          HD12      ILE  65   0.946  -6.658   9.877
  482   3HD1  ILE  65          HD13      ILE  65   0.527  -7.772  11.178
  483    H    ILE  66           HN       ILE  66   5.644  -4.354  11.700
  484    HA   ILE  66           HA       ILE  66   5.043  -3.023  14.253
  485    HB   ILE  66           HB       ILE  66   7.252  -1.871  14.058
  486   1HG1  ILE  66          HG12      ILE  66   8.905  -3.433  12.643
  487   2HG1  ILE  66          HG11      ILE  66   7.447  -3.668  11.692
  488   1HG2  ILE  66          HG21      ILE  66   7.303  -4.868  14.337
  489   2HG2  ILE  66          HG22      ILE  66   6.981  -3.690  15.610
  490   3HG2  ILE  66          HG23      ILE  66   8.582  -3.780  14.876
  491   1HD1  ILE  66          HD11      ILE  66   8.881  -1.868  10.831
  492   2HD1  ILE  66          HD12      ILE  66   8.651  -0.990  12.342
  493   3HD1  ILE  66          HD13      ILE  66   7.274  -1.304  11.286
  494    H    GLU  67           HN       GLU  67   4.921  -0.708  14.119
  495    HA   GLU  67           HA       GLU  67   4.309   0.249  11.404
  496   1HB   GLU  67          HB2       GLU  67   2.314   0.055  12.794
  497   2HB   GLU  67          HB1       GLU  67   3.071   1.015  14.053
  498   1HG   GLU  67          HG2       GLU  67   3.026   2.971  12.666
  499   2HG   GLU  67          HG1       GLU  67   2.439   2.030  11.293
  500    H    GLY  68           HN       GLY  68   5.160   2.178  10.762
  501   1HA   GLY  68          HA2       GLY  68   7.417   3.222  12.154
  502   2HA   GLY  68          HA1       GLY  68   6.652   3.934  10.736
  503    H    TYR  69           HN       TYR  69   7.201   4.268  14.033
  504    HA   TYR  69           HA       TYR  69   4.729   5.729  14.537
  505   1HB   TYR  69          HB2       TYR  69   5.662   4.010  16.145
  506   2HB   TYR  69          HB1       TYR  69   6.951   5.157  16.498
  507    HD1  TYR  69           HD1      TYR  69   6.616   6.012  18.624
  508    HD2  TYR  69           HD2      TYR  69   3.276   5.584  16.024
  509    HE1  TYR  69           HE1      TYR  69   5.178   7.099  20.298
  510    HE2  TYR  69           HE2      TYR  69   1.831   6.669  17.688
  511    HH   TYR  69           HH       TYR  69   1.773   7.080  20.071
  512    H    ASP  70           HN       ASP  70   8.189   6.286  14.250
  513    HA   ASP  70           HA       ASP  70   8.036   8.980  15.183
  514   1HB   ASP  70          HB2       ASP  70  10.351   9.191  14.703
  515   2HB   ASP  70          HB1       ASP  70  10.113   7.553  15.284
  516    HA   PRO  71           HA       PRO  71   7.585  10.201  10.678
  517   1HB   PRO  71          HB2       PRO  71   7.155   8.196   8.804
  518   2HB   PRO  71          HB1       PRO  71   8.707   8.964   9.135
  519   1HG   PRO  71          HG2       PRO  71   7.971   6.263   9.634
  520   2HG   PRO  71          HG1       PRO  71   9.489   7.066  10.066
  521   1HD   PRO  71          HD2       PRO  71   7.104   6.504  11.736
  522   2HD   PRO  71          HD1       PRO  71   8.805   6.687  12.214
  523    HA   PRO  72           HA       PRO  72   3.173   9.717  11.458
  524   1HB   PRO  72          HB2       PRO  72   2.946  12.309  10.114
  525   2HB   PRO  72          HB1       PRO  72   2.575  11.879  11.785
  526   1HG   PRO  72          HG2       PRO  72   4.681  13.430  11.143
  527   2HG   PRO  72          HG1       PRO  72   4.720  12.303  12.512
  528   1HD   PRO  72          HD2       PRO  72   5.866  11.980   9.760
  529   2HD   PRO  72          HD1       PRO  72   6.586  11.573  11.333
  530    H    GLU  73           HN       GLU  73   4.574   8.850   8.897
  531    HA   GLU  73           HA       GLU  73   2.762   9.505   6.772
  532   1HB   GLU  73          HB2       GLU  73   4.925   7.406   6.995
  533   2HB   GLU  73          HB1       GLU  73   4.034   7.764   5.522
  534   1HG   GLU  73          HG2       GLU  73   5.769   9.713   7.020
  535   2HG   GLU  73          HG1       GLU  73   6.243   8.820   5.575
  536    H    GLY  74           HN       GLY  74   3.208   6.876   9.050
  537   1HA   GLY  74          HA2       GLY  74   1.681   5.276   9.731
  538   2HA   GLY  74          HA1       GLY  74   0.529   5.934   8.578
  539    H    TRP  75           HN       TRP  75   3.276   3.781   8.968
  540    HA   TRP  75           HA       TRP  75   2.212   2.156   6.804
  541   1HB   TRP  75          HB2       TRP  75   4.531   1.797   5.888
  542   2HB   TRP  75          HB1       TRP  75   3.851   3.389   5.586
  543    HD1  TRP  75           HD1      TRP  75   5.114   5.461   6.565
  544    HE1  TRP  75           HE1      TRP  75   7.388   5.768   7.729
  545    HE3  TRP  75           HE3      TRP  75   6.168   0.557   7.599
  546    HZ2  TRP  75           HZ2      TRP  75   9.360   4.147   8.935
  547    HZ3  TRP  75           HZ3      TRP  75   8.269   0.026   8.760
  548    HH2  TRP  75           HH2      TRP  75   9.832   1.784   9.414
  549    H    GLY  76           HN       GLY  76   2.929  -0.031   6.852
  550   1HA   GLY  76          HA2       GLY  76   3.982  -0.812   9.499
  551   2HA   GLY  76          HA1       GLY  76   2.655  -1.661   8.718
  552    H    TRP  77           HN       TRP  77   5.555  -2.265   9.565
  553    HA   TRP  77           HA       TRP  77   6.420  -3.449   7.009
  554   1HB   TRP  77          HB2       TRP  77   8.091  -1.944   7.894
  555   2HB   TRP  77          HB1       TRP  77   8.001  -2.705   9.475
  556    HD1  TRP  77           HD1      TRP  77   9.539  -4.762   9.907
  557    HE1  TRP  77           HE1      TRP  77  11.309  -6.001   8.508
  558    HE3  TRP  77           HE3      TRP  77   8.593  -2.653   5.348
  559    HZ2  TRP  77           HZ2      TRP  77  12.187  -6.075   5.828
  560    HZ3  TRP  77           HZ3      TRP  77   9.944  -3.362   3.421
  561    HH2  TRP  77           HH2      TRP  77  11.703  -5.037   3.656
  562    H    CYS  78           HN       CYS  78   6.368  -5.589   6.824
  563    HA   CYS  78           HA       CYS  78   5.842  -7.156   9.260
  564   1HB   CYS  78          HB2       CYS  78   4.231  -7.107   7.202
  565   2HB   CYS  78          HB1       CYS  78   5.412  -8.182   6.469
  566    H    TYR  79           HN       TYR  79   7.596  -8.127  10.028
  567    HA   TYR  79           HA       TYR  79  10.084  -8.067   8.825
  568   1HB   TYR  79          HB2       TYR  79   9.023  -9.780  11.057
  569   2HB   TYR  79          HB1       TYR  79  10.709  -9.833  10.554
  570    HD1  TYR  79           HD1      TYR  79  11.918  -7.508  10.462
  571    HD2  TYR  79           HD2      TYR  79   8.401  -8.290  12.724
  572    HE1  TYR  79           HE1      TYR  79  12.431  -5.591  11.910
  573    HE2  TYR  79           HE2      TYR  79   8.899  -6.367  14.174
  574    HH   TYR  79           HH       TYR  79  10.964  -5.072  14.864
  575    H    VAL  80           HN       VAL  80   8.114 -11.031   9.231
  576    HA   VAL  80           HA       VAL  80   9.959 -12.633   7.808
  577    HB   VAL  80           HB       VAL  80   8.141 -14.354   7.777
  578   1HG1  VAL  80          HG11      VAL  80   8.748 -13.024  10.416
  579   2HG1  VAL  80          HG12      VAL  80   9.722 -14.252   9.607
  580   3HG1  VAL  80          HG13      VAL  80   8.120 -14.660  10.224
  581   1HG2  VAL  80          HG21      VAL  80   6.109 -13.906   9.084
  582   2HG2  VAL  80          HG22      VAL  80   6.208 -12.878   7.655
  583   3HG2  VAL  80          HG23      VAL  80   6.592 -12.218   9.245
  584    H    ASP  81           HN       ASP  81   7.449 -10.573   6.746
  585    HA   ASP  81           HA       ASP  81   7.146 -11.872   4.164
  586   1HB   ASP  81          HB2       ASP  81   6.034  -9.229   5.136
  587   2HB   ASP  81          HB1       ASP  81   5.578 -10.061   3.657
  588    H    GLU  82           HN       GLU  82   8.612  -9.042   5.601
  589    HA   GLU  82           HA       GLU  82  10.069  -7.482   4.898
  590   1HB   GLU  82          HB2       GLU  82  10.630  -9.584   2.824
  591   2HB   GLU  82          HB1       GLU  82  11.454  -8.030   2.810
  592   1HG   GLU  82          HG2       GLU  82  12.249  -8.458   5.097
  593   2HG   GLU  82          HG1       GLU  82  11.478 -10.043   5.045
  594    H    VAL  83           HN       VAL  83   7.288  -7.529   4.038
  595    HA   VAL  83           HA       VAL  83   7.555  -5.697   1.756
  596    HB   VAL  83           HB       VAL  83   5.187  -6.079   1.243
  597   1HG1  VAL  83          HG11      VAL  83   5.370  -8.415   0.440
  598   2HG1  VAL  83          HG12      VAL  83   6.845  -8.589   1.393
  599   3HG1  VAL  83          HG13      VAL  83   6.784  -7.430   0.065
  600   1HG2  VAL  83          HG21      VAL  83   5.272  -8.152   3.432
  601   2HG2  VAL  83          HG22      VAL  83   3.935  -7.892   2.311
  602   3HG2  VAL  83          HG23      VAL  83   4.372  -6.637   3.471
  603    H    MET  84           HN       MET  84   6.901  -3.646   2.002
  604    HA   MET  84           HA       MET  84   5.854  -2.879   4.633
  605   1HB   MET  84          HB2       MET  84   7.910  -1.755   3.847
  606   2HB   MET  84          HB1       MET  84   7.040  -1.165   2.438
  607   1HG   MET  84          HG2       MET  84   5.560   0.126   3.885
  608   2HG   MET  84          HG1       MET  84   6.421  -0.472   5.301
  609   1HE   MET  84          HE1       MET  84   9.430  -0.473   4.236
  610   2HE   MET  84          HE2       MET  84   8.973   0.115   5.835
  611   3HE   MET  84          HE3       MET  84   9.980   1.110   4.784
  612    H    PHE  85           HN       PHE  85   3.796  -2.345   4.853
  613    HA   PHE  85           HA       PHE  85   2.297  -1.567   2.441
  614   1HB   PHE  85          HB2       PHE  85   0.274  -2.518   3.625
  615   2HB   PHE  85          HB1       PHE  85   1.462  -3.700   3.093
  616    HD1  PHE  85           HD1      PHE  85  -0.058  -2.052   5.986
  617    HD2  PHE  85           HD2      PHE  85   2.744  -4.976   4.677
  618    HE1  PHE  85           HE1      PHE  85   0.025  -2.983   8.258
  619    HE2  PHE  85           HE2      PHE  85   2.836  -5.910   6.952
  620    HZ   PHE  85           HZ       PHE  85   1.476  -4.912   8.746
  621    H    ASP  86           HN       ASP  86   0.183  -0.345   3.164
  622    HA   ASP  86           HA       ASP  86   1.220   1.872   4.767
  623   1HB   ASP  86          HB2       ASP  86  -0.108   3.302   3.551
  624   2HB   ASP  86          HB1       ASP  86   0.127   2.033   2.356
  625    H    LEU  87           HN       LEU  87   0.113   2.742   6.491
  626    HA   LEU  87           HA       LEU  87  -2.315   1.367   7.396
  627   1HB   LEU  87          HB2       LEU  87   0.193   1.819   9.007
  628   2HB   LEU  87          HB1       LEU  87  -1.365   1.531   9.756
  629    HG   LEU  87           HG       LEU  87   0.045  -0.392   7.901
  630   1HD1  LEU  87          HD11      LEU  87   0.397  -1.730   9.924
  631   2HD1  LEU  87          HD12      LEU  87  -0.289  -0.429  10.899
  632   3HD1  LEU  87          HD13      LEU  87   1.218  -0.172  10.020
  633   1HD2  LEU  87          HD21      LEU  87  -2.395  -0.575   7.815
  634   2HD2  LEU  87          HD22      LEU  87  -2.448  -0.715   9.573
  635   3HD2  LEU  87          HD23      LEU  87  -1.673  -1.974   8.611
  636    H    SER  88           HN       SER  88  -1.545   4.008   6.186
  637    HA   SER  88           HA       SER  88  -1.350   6.053   8.045
  638   1HB   SER  88          HB2       SER  88  -0.908   6.338   5.652
  639   2HB   SER  88          HB1       SER  88  -2.623   6.135   5.301
  640    HG   SER  88           HG       SER  88  -1.422   8.230   6.818
  641    H    ASP  89           HN       ASP  89  -4.258   4.480   6.782
  642    HA   ASP  89           HA       ASP  89  -6.037   6.456   7.889
  643   1HB   ASP  89          HB2       ASP  89  -6.685   3.673   6.895
  644   2HB   ASP  89          HB1       ASP  89  -7.838   4.967   7.188
  645    H    ARG  90           HN       ARG  90  -4.434   3.703   9.126
  646    HA   ARG  90           HA       ARG  90  -6.371   3.498  11.347
  647   1HB   ARG  90          HB2       ARG  90  -4.803   1.150  10.300
  648   2HB   ARG  90          HB1       ARG  90  -6.240   1.142  11.314
  649   1HG   ARG  90          HG2       ARG  90  -7.618   1.813   9.479
  650   2HG   ARG  90          HG1       ARG  90  -6.207   2.062   8.451
  651   1HD   ARG  90          HD2       ARG  90  -5.721  -0.433   8.920
  652   2HD   ARG  90          HD1       ARG  90  -7.412  -0.502   9.421
  653    HE   ARG  90           HE       ARG  90  -7.514   0.714   6.995
  654   1HH1  ARG  90          HH11      ARG  90  -6.215  -2.333   8.151
  655   2HH1  ARG  90          HH12      ARG  90  -6.267  -3.078   6.583
  656   1HH2  ARG  90          HH21      ARG  90  -7.601  -0.285   4.956
  657   2HH2  ARG  90          HH22      ARG  90  -7.053  -1.927   4.780
  658    H    MET  91           HN       MET  91  -3.627   4.794  10.844
  659    HA   MET  91           HA       MET  91  -1.705   3.265  12.268
  660   1HB   MET  91          HB2       MET  91  -0.251   5.186  12.072
  661   2HB   MET  91          HB1       MET  91  -1.091   4.933  10.549
  662   1HG   MET  91          HG2       MET  91  -2.592   6.748  11.013
  663   2HG   MET  91          HG1       MET  91  -1.913   6.944  12.627
  664   1HE   MET  91          HE1       MET  91   1.699   8.233  11.847
  665   2HE   MET  91          HE2       MET  91   1.222   6.546  12.038
  666   3HE   MET  91          HE3       MET  91   0.548   7.780  13.103
  667    H    THR  92           HN       THR  92  -0.558   4.005  14.184
  668    HA   THR  92           HA       THR  92  -2.429   4.697  16.280
  669    HB   THR  92           HB       THR  92   0.533   4.339  16.661
  670    HG1  THR  92           HG1      THR  92  -0.062   2.556  15.436
  671   1HG2  THR  92          HG21      THR  92  -1.876   3.642  18.348
  672   2HG2  THR  92          HG22      THR  92  -0.805   5.022  18.592
  673   3HG2  THR  92          HG23      THR  92  -0.192   3.382  18.804
  674    HA   PRO  93           HA       PRO  93  -1.380   9.072  15.858
  675   1HB   PRO  93          HB2       PRO  93  -2.999   9.216  18.332
  676   2HB   PRO  93          HB1       PRO  93  -3.193  10.091  16.811
  677   1HG   PRO  93          HG2       PRO  93  -4.874   8.132  17.497
  678   2HG   PRO  93          HG1       PRO  93  -4.368   8.364  15.812
  679   1HD   PRO  93          HD2       PRO  93  -3.426   6.349  17.816
  680   2HD   PRO  93          HD1       PRO  93  -3.759   6.145  16.082
  681    H    HIS  94           HN       HIS  94   0.233  10.244  16.790
  682    HA   HIS  94           HA       HIS  94   1.901   8.990  18.680
  683   1HB   HIS  94          HB2       HIS  94   3.256  11.003  18.638
  684   2HB   HIS  94          HB1       HIS  94   2.749  10.599  17.006
  685    HD1  HIS  94           HD1      HIS  94   1.241  12.281  15.780
  686    HD2  HIS  94           HD2      HIS  94   2.176  13.382  19.683
  687    HE1  HIS  94           HE1      HIS  94   0.531  14.686  16.004
  688    HE2  HIS  94           HE2      HIS  94   0.914  15.254  18.430
  689    H    ASN  95           HN       ASN  95   2.156   9.196  20.826
  690    HA   ASN  95           HA       ASN  95  -0.076  10.338  22.287
  691   1HB   ASN  95          HB2       ASN  95   0.834   9.183  24.215
  692   2HB   ASN  95          HB1       ASN  95   0.826   8.086  22.839
  693   1HD2  ASN  95          HD21      ASN  95   2.402   7.915  25.229
  694   2HD2  ASN  95          HD22      ASN  95   4.060   7.973  24.739
  695    H    GLY  96           HN       GLY  96   2.887  11.407  21.233
  696   1HA   GLY  96          HA2       GLY  96   2.628  13.913  22.498
  697   2HA   GLY  96          HA1       GLY  96   3.870  12.971  23.315
  698    HA   PRO  97           HA       PRO  97   5.592  15.125  19.453
  699   1HB   PRO  97          HB2       PRO  97   7.288  16.540  21.398
  700   2HB   PRO  97          HB1       PRO  97   6.346  17.188  20.052
  701   1HG   PRO  97          HG2       PRO  97   5.619  17.590  22.606
  702   2HG   PRO  97          HG1       PRO  97   4.423  17.378  21.313
  703   1HD   PRO  97          HD2       PRO  97   5.379  15.405  23.355
  704   2HD   PRO  97          HD1       PRO  97   3.731  15.702  22.760
  705    H    ILE  98           HN       ILE  98   6.918  13.650  18.603
  706    HA   ILE  98           HA       ILE  98   8.858  12.286  20.298
  707    HB   ILE  98           HB       ILE  98   8.186  11.821  17.387
  708   1HG1  ILE  98          HG12      ILE  98   7.316  10.358  19.892
  709   2HG1  ILE  98          HG11      ILE  98   6.288  11.346  18.859
  710   1HG2  ILE  98          HG21      ILE  98   9.388   9.707  17.662
  711   2HG2  ILE  98          HG22      ILE  98   9.805  10.156  19.316
  712   3HG2  ILE  98          HG23      ILE  98  10.445  11.087  17.962
  713   1HD1  ILE  98          HD11      ILE  98   7.636   8.771  18.090
  714   2HD1  ILE  98          HD12      ILE  98   6.643   9.766  17.023
  715   3HD1  ILE  98          HD13      ILE  98   5.922   8.997  18.438
  716    HA   PRO  99           HA       PRO  99  11.880  15.245  18.884
  717   1HB   PRO  99          HB2       PRO  99  13.846  14.512  20.576
  718   2HB   PRO  99          HB1       PRO  99  12.443  15.449  21.101
  719   1HG   PRO  99          HG2       PRO  99  12.998  12.531  21.409
  720   2HG   PRO  99          HG1       PRO  99  12.260  13.661  22.558
  721   1HD   PRO  99          HD2       PRO  99  10.845  11.905  20.991
  722   2HD   PRO  99          HD1       PRO  99  10.183  13.418  21.639
  723    H    ARG 100           HN       ARG 100  12.781  14.896  16.966
  724    HA   ARG 100           HA       ARG 100  14.259  12.500  16.345
  725   1HB   ARG 100          HB2       ARG 100  12.979  13.801  14.637
  726   2HB   ARG 100          HB1       ARG 100  14.105  15.130  14.843
  727   1HG   ARG 100          HG2       ARG 100  15.098  12.425  14.034
  728   2HG   ARG 100          HG1       ARG 100  14.380  13.508  12.843
  729   1HD   ARG 100          HD2       ARG 100  16.818  13.993  14.547
  730   2HD   ARG 100          HD1       ARG 100  16.750  13.816  12.795
  731    HE   ARG 100           HE       ARG 100  15.128  15.981  13.531
  732   1HH1  ARG 100          HH11      ARG 100  18.524  15.094  13.316
  733   2HH1  ARG 100          HH12      ARG 100  19.066  16.753  13.284
  734   1HH2  ARG 100          HH21      ARG 100  15.867  18.146  13.484
  735   2HH2  ARG 100          HH22      ARG 100  17.575  18.464  13.373
  736    H    TYR 101           HN       TYR 101  16.222  12.164  17.169
  737    HA   TYR 101           HA       TYR 101  17.740  14.409  18.205
  738   1HB   TYR 101          HB2       TYR 101  18.184  11.428  18.375
  739   2HB   TYR 101          HB1       TYR 101  19.268  12.620  19.081
  740    HD1  TYR 101           HD1      TYR 101  17.751  14.500  20.471
  741    HD2  TYR 101           HD2      TYR 101  16.869  10.375  19.923
  742    HE1  TYR 101           HE1      TYR 101  16.417  14.517  22.536
  743    HE2  TYR 101           HE2      TYR 101  15.526  10.382  21.981
  744    HH   TYR 101           HH       TYR 101  15.445  11.724  24.110
  745    H    VAL 102           HN       VAL 102  18.166  11.813  15.825
  746    HA   VAL 102           HA       VAL 102  20.582  13.204  14.908
  747    HB   VAL 102           HB       VAL 102  21.244  10.939  13.940
  748   1HG1  VAL 102          HG11      VAL 102  22.182  10.186  16.066
  749   2HG1  VAL 102          HG12      VAL 102  21.052  11.221  16.939
  750   3HG1  VAL 102          HG13      VAL 102  22.295  11.940  15.916
  751   1HG2  VAL 102          HG21      VAL 102  19.081   9.824  14.114
  752   2HG2  VAL 102          HG22      VAL 102  19.115  10.005  15.868
  753   3HG2  VAL 102          HG23      VAL 102  20.297   8.971  15.066
  Start of MODEL   16
    1   1H    MET   1          HT1       MET   1   3.272   1.651  -1.686
    2   2H    MET   1          HT2       MET   1   4.581   1.544  -0.616
    3   3H    MET   1          HT3       MET   1   3.079   2.115  -0.065
    4    HA   MET   1           HA       MET   1   3.512  -0.147   0.649
    5   1HB   MET   1          HB2       MET   1   1.387  -1.115  -0.072
    6   2HB   MET   1          HB1       MET   1   1.198   0.587   0.317
    7   1HG   MET   1          HG2       MET   1   1.204   1.153  -2.039
    8   2HG   MET   1          HG1       MET   1   1.465  -0.539  -2.461
    9   1HE   MET   1          HE1       MET   1  -0.842   1.164  -3.746
   10   2HE   MET   1          HE2       MET   1  -2.205   0.048  -3.647
   11   3HE   MET   1          HE3       MET   1  -0.605  -0.549  -4.093
   12    H    THR   2           HN       THR   2   4.267  -2.127   0.238
   13    HA   THR   2           HA       THR   2   5.334  -2.630  -2.436
   14    HB   THR   2           HB       THR   2   5.809  -4.324   0.012
   15    HG1  THR   2           HG1      THR   2   7.757  -2.459  -0.516
   16   1HG2  THR   2          HG21      THR   2   7.937  -4.800  -1.100
   17   2HG2  THR   2          HG22      THR   2   7.492  -3.721  -2.422
   18   3HG2  THR   2          HG23      THR   2   6.572  -5.199  -2.144
   19    H    MET   3           HN       MET   3   3.671  -4.439   0.143
   20    HA   MET   3           HA       MET   3   1.740  -5.606  -1.562
   21   1HB   MET   3          HB2       MET   3   3.706  -6.880  -2.359
   22   2HB   MET   3          HB1       MET   3   4.018  -7.416  -0.715
   23   1HG   MET   3          HG2       MET   3   2.927  -9.139  -2.051
   24   2HG   MET   3          HG1       MET   3   1.932  -8.641  -0.684
   25   1HE   MET   3          HE1       MET   3   2.515  -8.257  -4.556
   26   2HE   MET   3          HE2       MET   3   2.436  -6.580  -4.013
   27   3HE   MET   3          HE3       MET   3   1.148  -7.243  -5.020
   28    H    GLY   4           HN       GLY   4   0.163  -6.689  -0.372
   29   1HA   GLY   4          HA2       GLY   4   0.201  -6.212   2.466
   30   2HA   GLY   4          HA1       GLY   4  -1.103  -6.953   1.548
   31    H    CYS   5           HN       CYS   5  -0.899  -8.186   3.774
   32    HA   CYS   5           HA       CYS   5   0.176 -10.760   3.096
   33   1HB   CYS   5          HB2       CYS   5   2.216  -9.736   3.911
   34   2HB   CYS   5          HB1       CYS   5   1.401  -9.194   5.374
   35    H    ARG   6           HN       ARG   6  -0.642 -12.428   4.395
   36    HA   ARG   6           HA       ARG   6  -3.183 -12.050   5.465
   37   1HB   ARG   6          HB2       ARG   6  -2.877 -14.338   6.454
   38   2HB   ARG   6          HB1       ARG   6  -2.560 -14.219   4.730
   39   1HG   ARG   6          HG2       ARG   6  -0.202 -14.304   5.082
   40   2HG   ARG   6          HG1       ARG   6  -0.404 -14.154   6.829
   41   1HD   ARG   6          HD2       ARG   6  -1.504 -16.448   5.214
   42   2HD   ARG   6          HD1       ARG   6   0.078 -16.478   5.995
   43    HE   ARG   6           HE       ARG   6  -0.984 -16.463   8.108
   44   1HH1  ARG   6          HH11      ARG   6  -3.254 -16.659   5.437
   45   2HH1  ARG   6          HH12      ARG   6  -4.575 -17.178   6.442
   46   1HH2  ARG   6          HH21      ARG   6  -2.698 -17.182   9.406
   47   2HH2  ARG   6          HH22      ARG   6  -4.256 -17.502   8.697
   48    H    HIS   7           HN       HIS   7  -0.089 -11.742   7.023
   49    HA   HIS   7           HA       HIS   7  -0.901 -11.996   9.700
   50   1HB   HIS   7          HB2       HIS   7   1.373 -10.469   8.436
   51   2HB   HIS   7          HB1       HIS   7   1.121 -10.509  10.175
   52    HD2  HIS   7           HD2      HIS   7   0.582 -13.671  10.597
   53    HE1  HIS   7           HE1      HIS   7   4.315 -14.111   8.653
   54    HE2  HIS   7           HE2      HIS   7   2.504 -15.302   9.973
   55    H    VAL   8           HN       VAL   8  -1.359  -9.429   7.408
   56    HA   VAL   8           HA       VAL   8  -1.632  -7.269   9.241
   57    HB   VAL   8           HB       VAL   8  -2.964  -7.458   6.543
   58   1HG1  VAL   8          HG11      VAL   8  -2.701  -5.023   6.536
   59   2HG1  VAL   8          HG12      VAL   8  -2.004  -5.103   8.154
   60   3HG1  VAL   8          HG13      VAL   8  -3.682  -5.579   7.891
   61   1HG2  VAL   8          HG21      VAL   8  -0.654  -8.042   6.256
   62   2HG2  VAL   8          HG22      VAL   8  -0.153  -6.626   7.180
   63   3HG2  VAL   8          HG23      VAL   8  -0.950  -6.425   5.620
   64    H    ALA   9           HN       ALA   9  -3.764  -9.749   8.084
   65    HA   ALA   9           HA       ALA   9  -6.173  -8.386   8.675
   66   1HB   ALA   9          HB1       ALA   9  -6.082 -10.153   7.012
   67   2HB   ALA   9          HB2       ALA   9  -7.250 -10.548   8.273
   68   3HB   ALA   9          HB3       ALA   9  -5.668 -11.326   8.262
   69    H    GLY  10           HN       GLY  10  -3.868  -9.651  10.701
   70   1HA   GLY  10          HA2       GLY  10  -5.862 -10.310  12.774
   71   2HA   GLY  10          HA1       GLY  10  -4.260 -11.023  12.694
   72    H    ILE  11           HN       ILE  11  -3.902  -7.826  11.898
   73    HA   ILE  11           HA       ILE  11  -2.885  -7.286  14.581
   74    HB   ILE  11           HB       ILE  11  -1.735  -5.361  13.619
   75   1HG1  ILE  11          HG12      ILE  11  -2.932  -6.243  10.982
   76   2HG1  ILE  11          HG11      ILE  11  -3.410  -4.808  11.881
   77   1HG2  ILE  11          HG21      ILE  11  -0.646  -7.540  13.620
   78   2HG2  ILE  11          HG22      ILE  11  -0.153  -6.586  12.222
   79   3HG2  ILE  11          HG23      ILE  11  -1.324  -7.890  12.030
   80   1HD1  ILE  11          HD11      ILE  11  -1.935  -4.258  10.034
   81   2HD1  ILE  11          HD12      ILE  11  -0.693  -5.320  10.698
   82   3HD1  ILE  11          HD13      ILE  11  -1.182  -3.875  11.583
   83    H    ARG  12           HN       ARG  12  -3.285  -5.301  15.662
   84    HA   ARG  12           HA       ARG  12  -5.967  -4.237  15.061
   85   1HB   ARG  12          HB2       ARG  12  -6.210  -3.813  17.447
   86   2HB   ARG  12          HB1       ARG  12  -5.820  -5.507  17.176
   87   1HG   ARG  12          HG2       ARG  12  -3.673  -5.283  18.019
   88   2HG   ARG  12          HG1       ARG  12  -3.658  -3.534  17.782
   89   1HD   ARG  12          HD2       ARG  12  -3.854  -3.966  20.123
   90   2HD   ARG  12          HD1       ARG  12  -5.397  -3.343  19.547
   91    HE   ARG  12           HE       ARG  12  -5.087  -6.244  19.747
   92   1HH1  ARG  12          HH11      ARG  12  -6.471  -3.264  20.967
   93   2HH1  ARG  12          HH12      ARG  12  -7.563  -4.064  22.057
   94   1HH2  ARG  12          HH21      ARG  12  -6.543  -7.303  21.185
   95   2HH2  ARG  12          HH22      ARG  12  -7.587  -6.346  22.196
   96    H    THR  13           HN       THR  13  -6.264  -1.994  16.135
   97    HA   THR  13           HA       THR  13  -3.945  -0.308  15.545
   98    HB   THR  13           HB       THR  13  -6.755   0.538  16.298
   99    HG1  THR  13           HG1      THR  13  -7.037  -0.357  14.344
  100   1HG2  THR  13          HG21      THR  13  -5.069   2.264  16.699
  101   2HG2  THR  13          HG22      THR  13  -6.087   2.699  15.326
  102   3HG2  THR  13          HG23      THR  13  -4.463   2.069  15.055
  103    H    VAL  14           HN       VAL  14  -2.697   0.479  17.152
  104    HA   VAL  14           HA       VAL  14  -3.551  -0.215  19.881
  105    HB   VAL  14           HB       VAL  14  -1.132  -0.378  20.418
  106   1HG1  VAL  14          HG11      VAL  14  -0.744  -2.504  19.236
  107   2HG1  VAL  14          HG12      VAL  14  -2.101  -2.138  18.170
  108   3HG1  VAL  14          HG13      VAL  14  -2.376  -2.388  19.894
  109   1HG2  VAL  14          HG21      VAL  14  -0.781  -0.050  17.439
  110   2HG2  VAL  14          HG22      VAL  14   0.485  -0.515  18.576
  111   3HG2  VAL  14          HG23      VAL  14  -0.251   1.084  18.682
  112    H    THR  15           HN       THR  15  -2.545   1.039  21.618
  113    HA   THR  15           HA       THR  15  -2.287   3.882  20.928
  114    HB   THR  15           HB       THR  15  -2.600   2.639  23.670
  115    HG1  THR  15           HG1      THR  15  -4.400   2.792  21.729
  116   1HG2  THR  15          HG21      THR  15  -3.288   4.898  24.333
  117   2HG2  THR  15          HG22      THR  15  -2.999   5.470  22.690
  118   3HG2  THR  15          HG23      THR  15  -1.652   4.897  23.673
  119    HA   PRO  16           HA       PRO  16   2.127   3.373  21.295
  120   1HB   PRO  16          HB2       PRO  16   2.057   6.297  21.775
  121   2HB   PRO  16          HB1       PRO  16   2.948   5.371  20.560
  122   1HG   PRO  16          HG2       PRO  16   0.807   6.817  19.887
  123   2HG   PRO  16          HG1       PRO  16   1.133   5.247  19.130
  124   1HD   PRO  16          HD2       PRO  16  -0.838   5.950  21.263
  125   2HD   PRO  16          HD1       PRO  16  -1.006   4.831  19.894
  126    H    SER  17           HN       SER  17   2.853   2.496  23.112
  127    HA   SER  17           HA       SER  17   2.176   3.142  25.722
  128   1HB   SER  17          HB2       SER  17   3.289   1.039  25.036
  129   2HB   SER  17          HB1       SER  17   4.778   1.934  24.745
  130    HG   SER  17           HG       SER  17   5.121   2.112  26.856
  131    H    ALA  18           HN       ALA  18   4.673   4.508  23.661
  132    HA   ALA  18           HA       ALA  18   5.197   6.531  25.707
  133   1HB   ALA  18          HB1       ALA  18   7.605   6.379  25.363
  134   2HB   ALA  18          HB2       ALA  18   7.370   5.031  24.250
  135   3HB   ALA  18          HB3       ALA  18   6.956   4.849  25.955
  136    H    LEU  19           HN       LEU  19   6.745   8.243  24.692
  137    HA   LEU  19           HA       LEU  19   5.486   9.110  22.218
  138   1HB   LEU  19          HB2       LEU  19   7.413  10.440  24.122
  139   2HB   LEU  19          HB1       LEU  19   6.916  11.175  22.613
  140    HG   LEU  19           HG       LEU  19   4.547  11.106  23.434
  141   1HD1  LEU  19          HD11      LEU  19   4.770   9.335  25.095
  142   2HD1  LEU  19          HD12      LEU  19   4.152  10.818  25.822
  143   3HD1  LEU  19          HD13      LEU  19   5.840  10.359  26.052
  144   1HD2  LEU  19          HD21      LEU  19   4.804  13.010  24.924
  145   2HD2  LEU  19          HD22      LEU  19   5.913  13.122  23.556
  146   3HD2  LEU  19          HD23      LEU  19   6.511  12.622  25.138
  147    H    GLY  20           HN       GLY  20   8.722   8.396  23.444
  148   1HA   GLY  20          HA2       GLY  20   9.573   7.981  20.647
  149   2HA   GLY  20          HA1       GLY  20  10.652   8.599  21.894
  150    H    CYS  21           HN       CYS  21  12.127   6.876  21.615
  151    HA   CYS  21           HA       CYS  21  11.324   4.168  21.998
  152   1HB   CYS  21          HB2       CYS  21  14.036   5.493  22.153
  153   2HB   CYS  21          HB1       CYS  21  13.789   3.762  22.346
  154    HG   CYS  21           HG       CYS  21  14.296   5.403  19.616
  155    H    GLU  22           HN       GLU  22  10.116   4.086  23.846
  156    HA   GLU  22           HA       GLU  22  10.547   5.080  26.356
  157   1HB   GLU  22          HB2       GLU  22   8.609   3.703  25.550
  158   2HB   GLU  22          HB1       GLU  22   9.611   2.273  25.731
  159   1HG   GLU  22          HG2       GLU  22   9.812   2.771  28.141
  160   2HG   GLU  22          HG1       GLU  22   8.703   4.126  27.918
  161    H    GLU  23           HN       GLU  23  11.992   2.293  24.853
  162    HA   GLU  23           HA       GLU  23  13.427   1.219  26.992
  163   1HB   GLU  23          HB2       GLU  23  13.050   0.022  24.939
  164   2HB   GLU  23          HB1       GLU  23  13.915   1.239  24.017
  165   1HG   GLU  23          HG2       GLU  23  15.969   0.605  25.305
  166   2HG   GLU  23          HG1       GLU  23  15.045  -0.755  25.951
  167    H    CYS  24           HN       CYS  24  14.774   3.154  24.307
  168    HA   CYS  24           HA       CYS  24  17.264   3.544  25.520
  169   1HB   CYS  24          HB2       CYS  24  15.959   5.233  23.380
  170   2HB   CYS  24          HB1       CYS  24  17.683   5.132  23.727
  171    HG   CYS  24           HG       CYS  24  18.015   3.414  21.844
  172    H    LEU  25           HN       LEU  25  14.289   5.373  25.770
  173    HA   LEU  25           HA       LEU  25  15.385   7.806  26.682
  174   1HB   LEU  25          HB2       LEU  25  12.671   6.557  26.979
  175   2HB   LEU  25          HB1       LEU  25  13.054   8.104  27.711
  176    HG   LEU  25           HG       LEU  25  13.265   7.529  24.755
  177   1HD1  LEU  25          HD11      LEU  25  11.223   8.848  24.534
  178   2HD1  LEU  25          HD12      LEU  25  11.106   8.972  26.289
  179   3HD1  LEU  25          HD13      LEU  25  10.944   7.402  25.504
  180   1HD2  LEU  25          HD21      LEU  25  13.403  10.096  26.334
  181   2HD2  LEU  25          HD22      LEU  25  13.408   9.973  24.574
  182   3HD2  LEU  25          HD23      LEU  25  14.745   9.302  25.509
  183    H    LYS  26           HN       LYS  26  14.773   4.797  28.331
  184    HA   LYS  26           HA       LYS  26  14.642   5.894  30.955
  185   1HB   LYS  26          HB2       LYS  26  14.697   3.672  31.761
  186   2HB   LYS  26          HB1       LYS  26  13.812   3.604  30.245
  187   1HG   LYS  26          HG2       LYS  26  15.963   2.888  29.150
  188   2HG   LYS  26          HG1       LYS  26  16.636   2.726  30.772
  189   1HD   LYS  26          HD2       LYS  26  14.175   1.295  29.778
  190   2HD   LYS  26          HD1       LYS  26  15.791   0.592  29.836
  191   1HE   LYS  26          HE2       LYS  26  15.836   0.895  32.263
  192   2HE   LYS  26          HE1       LYS  26  14.225   1.611  32.207
  193   1HZ   LYS  26          HZ1       LYS  26  13.311  -0.447  31.461
  194   2HZ   LYS  26          HZ2       LYS  26  14.255  -0.773  32.834
  195   3HZ   LYS  26          HZ3       LYS  26  14.848  -1.144  31.291
  196    H    ILE  27           HN       ILE  27  17.241   5.188  28.809
  197    HA   ILE  27           HA       ILE  27  19.161   5.584  31.012
  198    HB   ILE  27           HB       ILE  27  20.840   4.425  29.595
  199   1HG1  ILE  27          HG12      ILE  27  18.432   3.768  27.876
  200   2HG1  ILE  27          HG11      ILE  27  19.807   4.760  27.407
  201   1HG2  ILE  27          HG21      ILE  27  19.721   3.243  31.383
  202   2HG2  ILE  27          HG22      ILE  27  19.969   2.159  30.014
  203   3HG2  ILE  27          HG23      ILE  27  18.375   2.849  30.314
  204   1HD1  ILE  27          HD11      ILE  27  21.271   2.820  27.584
  205   2HD1  ILE  27          HD12      ILE  27  19.950   2.536  26.450
  206   3HD1  ILE  27          HD13      ILE  27  19.895   1.828  28.064
  207    H    GLY  28           HN       GLY  28  17.715   7.340  28.813
  208   1HA   GLY  28          HA2       GLY  28  18.209   9.380  27.880
  209   2HA   GLY  28          HA1       GLY  28  19.727   9.334  28.763
  210    H    SER  29           HN       SER  29  18.640   6.999  26.362
  211    HA   SER  29           HA       SER  29  20.949   7.750  24.708
  212   1HB   SER  29          HB2       SER  29  19.362   5.170  24.803
  213   2HB   SER  29          HB1       SER  29  20.712   5.483  23.715
  214    HG   SER  29           HG       SER  29  21.285   6.009  26.339
  215    HA   PRO  30           HA       PRO  30  18.084   9.173  21.633
  216   1HB   PRO  30          HB2       PRO  30  19.781   9.454  19.568
  217   2HB   PRO  30          HB1       PRO  30  19.834  10.527  20.971
  218   1HG   PRO  30          HG2       PRO  30  21.585   8.205  20.292
  219   2HG   PRO  30          HG1       PRO  30  22.021   9.771  20.999
  220   1HD   PRO  30          HD2       PRO  30  21.693   7.447  22.440
  221   2HD   PRO  30          HD1       PRO  30  21.533   9.078  23.118
  222    H    TRP  31           HN       TRP  31  18.007   8.677  19.018
  223    HA   TRP  31           HA       TRP  31  18.341   5.888  18.411
  224   1HB   TRP  31          HB2       TRP  31  15.934   5.504  17.913
  225   2HB   TRP  31          HB1       TRP  31  16.247   5.737  19.629
  226    HD1  TRP  31           HD1      TRP  31  14.725   7.582  16.605
  227    HE1  TRP  31           HE1      TRP  31  13.099   9.371  17.487
  228    HE3  TRP  31           HE3      TRP  31  15.656   7.129  21.611
  229    HZ2  TRP  31           HZ2      TRP  31  12.311  10.445  19.975
  230    HZ3  TRP  31           HZ3      TRP  31  14.422   8.572  23.174
  231    HH2  TRP  31           HH2      TRP  31  12.785  10.196  22.371
  232    H    VAL  32           HN       VAL  32  17.500   5.430  16.162
  233    HA   VAL  32           HA       VAL  32  18.094   7.759  14.492
  234    HB   VAL  32           HB       VAL  32  17.831   4.872  13.629
  235   1HG1  VAL  32          HG11      VAL  32  17.578   6.475  11.815
  236   2HG1  VAL  32          HG12      VAL  32  19.118   5.626  11.671
  237   3HG1  VAL  32          HG13      VAL  32  19.075   7.277  12.290
  238   1HG2  VAL  32          HG21      VAL  32  20.280   4.801  13.666
  239   2HG2  VAL  32          HG22      VAL  32  19.614   5.084  15.275
  240   3HG2  VAL  32          HG23      VAL  32  20.315   6.421  14.362
  241    H    HIS  33           HN       HIS  33  15.792   5.020  14.467
  242    HA   HIS  33           HA       HIS  33  13.712   6.924  13.640
  243   1HB   HIS  33          HB2       HIS  33  14.144   4.172  12.457
  244   2HB   HIS  33          HB1       HIS  33  12.726   5.171  12.168
  245    HD1  HIS  33           HD1      HIS  33  13.069   7.320  10.681
  246    HD2  HIS  33           HD2      HIS  33  16.373   4.799  10.952
  247    HE1  HIS  33           HE1      HIS  33  14.638   8.046   8.854
  248    HE2  HIS  33           HE2      HIS  33  16.663   6.565   9.081
  249    H    LEU  34           HN       LEU  34  11.487   5.602  13.752
  250    HA   LEU  34           HA       LEU  34  11.425   4.268  16.372
  251   1HB   LEU  34          HB2       LEU  34   9.684   6.527  15.394
  252   2HB   LEU  34          HB1       LEU  34   9.274   5.532  16.777
  253    HG   LEU  34           HG       LEU  34  11.795   7.179  16.594
  254   1HD1  LEU  34          HD11      LEU  34  10.682   8.756  18.077
  255   2HD1  LEU  34          HD12      LEU  34   9.198   7.806  17.995
  256   3HD1  LEU  34          HD13      LEU  34   9.808   8.615  16.551
  257   1HD2  LEU  34          HD21      LEU  34  10.422   5.810  18.904
  258   2HD2  LEU  34          HD22      LEU  34  11.887   6.789  19.000
  259   3HD2  LEU  34          HD23      LEU  34  11.901   5.265  18.112
  260    H    ARG  35           HN       ARG  35  10.061   2.580  16.550
  261    HA   ARG  35           HA       ARG  35   8.015   2.153  14.492
  262   1HB   ARG  35          HB2       ARG  35  10.180   0.205  15.280
  263   2HB   ARG  35          HB1       ARG  35   8.682  -0.310  14.519
  264   1HG   ARG  35          HG2       ARG  35   9.180   0.871  12.530
  265   2HG   ARG  35          HG1       ARG  35  10.526   1.721  13.294
  266   1HD   ARG  35          HD2       ARG  35  11.750  -0.352  13.518
  267   2HD   ARG  35          HD1       ARG  35  10.392  -1.257  12.863
  268    HE   ARG  35           HE       ARG  35  10.980   0.539  10.905
  269   1HH1  ARG  35          HH11      ARG  35  12.777  -1.900  12.630
  270   2HH1  ARG  35          HH12      ARG  35  13.962  -2.120  11.376
  271   1HH2  ARG  35          HH21      ARG  35  12.478   0.225   9.206
  272   2HH2  ARG  35          HH22      ARG  35  13.773  -0.929   9.406
  273    H    ILE  36           HN       ILE  36   6.235   1.000  15.196
  274    HA   ILE  36           HA       ILE  36   6.230   0.075  17.984
  275    HB   ILE  36           HB       ILE  36   5.239   2.306  18.019
  276   1HG1  ILE  36          HG12      ILE  36   3.153   0.129  18.268
  277   2HG1  ILE  36          HG11      ILE  36   4.280   0.636  19.522
  278   1HG2  ILE  36          HG21      ILE  36   4.566   2.429  15.671
  279   2HG2  ILE  36          HG22      ILE  36   3.245   2.869  16.754
  280   3HG2  ILE  36          HG23      ILE  36   3.264   1.281  15.987
  281   1HD1  ILE  36          HD11      ILE  36   2.069   1.545  19.910
  282   2HD1  ILE  36          HD12      ILE  36   2.095   2.320  18.326
  283   3HD1  ILE  36          HD13      ILE  36   3.226   2.835  19.578
  284    H    CYS  37           HN       CYS  37   5.138  -1.845  18.268
  285    HA   CYS  37           HA       CYS  37   4.453  -3.388  15.998
  286   1HB   CYS  37          HB2       CYS  37   3.665  -3.770  18.880
  287   2HB   CYS  37          HB1       CYS  37   3.345  -4.935  17.609
  288    H    ARG  38           HN       ARG  38   2.497  -3.951  15.110
  289    HA   ARG  38           HA       ARG  38   0.173  -2.343  15.778
  290   1HB   ARG  38          HB2       ARG  38   0.599  -4.567  13.770
  291   2HB   ARG  38          HB1       ARG  38  -0.899  -3.663  13.944
  292   1HG   ARG  38          HG2       ARG  38   1.773  -2.519  13.154
  293   2HG   ARG  38          HG1       ARG  38   0.415  -2.843  12.074
  294   1HD   ARG  38          HD2       ARG  38   0.569  -0.828  14.303
  295   2HD   ARG  38          HD1       ARG  38   0.374  -0.522  12.577
  296    HE   ARG  38           HE       ARG  38  -1.711  -2.016  13.993
  297   1HH1  ARG  38          HH11      ARG  38  -0.686   0.911  12.335
  298   2HH1  ARG  38          HH12      ARG  38  -2.306   1.529  12.216
  299   1HH2  ARG  38          HH21      ARG  38  -3.811  -1.185  13.827
  300   2HH2  ARG  38          HH22      ARG  38  -4.069   0.360  13.071
  301    H    THR  39           HN       THR  39   1.216  -4.076  17.818
  302    HA   THR  39           HA       THR  39  -1.010  -5.927  18.200
  303    HB   THR  39           HB       THR  39   1.751  -6.889  18.850
  304    HG1  THR  39           HG1      THR  39   0.563  -7.508  16.361
  305   1HG2  THR  39          HG21      THR  39  -0.159  -8.146  19.681
  306   2HG2  THR  39          HG22      THR  39   0.697  -9.077  18.451
  307   3HG2  THR  39          HG23      THR  39  -0.815  -8.262  18.048
  308    H    CYS  40           HN       CYS  40   2.101  -5.401  19.895
  309    HA   CYS  40           HA       CYS  40   0.660  -5.401  22.399
  310   1HB   CYS  40          HB2       CYS  40   2.776  -5.611  23.493
  311   2HB   CYS  40          HB1       CYS  40   2.799  -6.666  22.090
  312    H    GLY  41           HN       GLY  41   1.523  -3.021  20.240
  313   1HA   GLY  41          HA2       GLY  41   1.251  -0.746  20.351
  314   2HA   GLY  41          HA1       GLY  41   0.580  -0.981  21.953
  315    H    HIS  42           HN       HIS  42   3.728  -2.250  21.665
  316    HA   HIS  42           HA       HIS  42   4.714  -0.012  23.254
  317   1HB   HIS  42          HB2       HIS  42   5.000  -2.452  23.962
  318   2HB   HIS  42          HB1       HIS  42   6.201  -2.573  22.679
  319    HD1  HIS  42           HD1      HIS  42   8.540  -2.012  23.363
  320    HD2  HIS  42           HD2      HIS  42   5.706  -0.340  25.909
  321    HE1  HIS  42           HE1      HIS  42   9.847  -0.877  25.186
  322    HE2  HIS  42           HE2      HIS  42   8.111   0.046  26.771
  323    H    VAL  43           HN       VAL  43   6.245   1.366  22.602
  324    HA   VAL  43           HA       VAL  43   7.129   1.248  19.828
  325    HB   VAL  43           HB       VAL  43   7.684   3.414  21.867
  326   1HG1  VAL  43          HG11      VAL  43   9.134   3.507  19.932
  327   2HG1  VAL  43          HG12      VAL  43   7.978   4.838  19.881
  328   3HG1  VAL  43          HG13      VAL  43   7.742   3.426  18.852
  329   1HG2  VAL  43          HG21      VAL  43   5.288   3.142  21.699
  330   2HG2  VAL  43          HG22      VAL  43   5.378   3.193  19.939
  331   3HG2  VAL  43          HG23      VAL  43   5.779   4.627  20.884
  332    H    GLY  44           HN       GLY  44   9.272   0.996  19.216
  333   1HA   GLY  44          HA2       GLY  44  11.261   0.700  21.356
  334   2HA   GLY  44          HA1       GLY  44  10.981  -0.664  20.283
  335    H    CYS  45           HN       CYS  45  13.466   0.402  20.496
  336    HA   CYS  45           HA       CYS  45  13.980   2.292  18.396
  337   1HB   CYS  45          HB2       CYS  45  16.372   1.746  18.897
  338   2HB   CYS  45          HB1       CYS  45  15.455   2.267  20.308
  339    HG   CYS  45           HG       CYS  45  15.357  -0.108  21.572
  340    H    CYS  46           HN       CYS  46  14.835   1.866  16.372
  341    HA   CYS  46           HA       CYS  46  13.988  -0.680  15.321
  342   1HB   CYS  46          HB2       CYS  46  15.292   1.605  13.846
  343   2HB   CYS  46          HB1       CYS  46  14.288   0.325  13.170
  344    HG   CYS  46           HG       CYS  46  13.294   2.968  15.089
  345    H    ASP  47           HN       ASP  47  15.508  -1.512  13.416
  346    HA   ASP  47           HA       ASP  47  17.913  -2.416  14.706
  347   1HB   ASP  47          HB2       ASP  47  18.250  -3.766  12.682
  348   2HB   ASP  47          HB1       ASP  47  16.619  -3.958  13.312
  349    H    ASP  48           HN       ASP  48  17.060   0.198  12.760
  350    HA   ASP  48           HA       ASP  48  19.673   0.734  11.708
  351   1HB   ASP  48          HB2       ASP  48  18.711   3.070  11.379
  352   2HB   ASP  48          HB1       ASP  48  17.892   1.766  10.531
  353    H    SER  49           HN       SER  49  18.081   1.126  14.701
  354    HA   SER  49           HA       SER  49  19.946   3.129  15.673
  355   1HB   SER  49          HB2       SER  49  17.681   1.737  17.128
  356   2HB   SER  49          HB1       SER  49  18.535   3.192  17.645
  357    HG   SER  49           HG       SER  49  17.359   3.249  15.110
  358    HA   PRO  50           HA       PRO  50  23.091   0.593  17.252
  359   1HB   PRO  50          HB2       PRO  50  22.528   1.853  19.902
  360   2HB   PRO  50          HB1       PRO  50  24.068   1.638  19.062
  361   1HG   PRO  50          HG2       PRO  50  22.850   3.999  19.058
  362   2HG   PRO  50          HG1       PRO  50  23.672   3.399  17.606
  363   1HD   PRO  50          HD2       PRO  50  20.763   3.604  18.186
  364   2HD   PRO  50          HD1       PRO  50  21.620   3.718  16.638
  365    H    HIS  51           HN       HIS  51  20.289   0.738  19.453
  366    HA   HIS  51           HA       HIS  51  20.974  -1.626  20.868
  367   1HB   HIS  51          HB2       HIS  51  18.539   0.081  20.669
  368   2HB   HIS  51          HB1       HIS  51  18.378  -1.522  21.369
  369    HD1  HIS  51           HD1      HIS  51  17.789  -0.526  23.647
  370    HD2  HIS  51           HD2      HIS  51  21.572   0.534  22.278
  371    HE1  HIS  51           HE1      HIS  51  18.936   0.548  25.606
  372    HE2  HIS  51           HE2      HIS  51  21.323   0.858  24.840
  373    H    LYS  52           HN       LYS  52  19.051  -1.018  17.993
  374    HA   LYS  52           HA       LYS  52  17.774  -2.326  16.635
  375   1HB   LYS  52          HB2       LYS  52  19.852  -4.431  17.255
  376   2HB   LYS  52          HB1       LYS  52  18.816  -4.360  15.840
  377   1HG   LYS  52          HG2       LYS  52  19.928  -2.172  15.282
  378   2HG   LYS  52          HG1       LYS  52  21.098  -2.545  16.547
  379   1HD   LYS  52          HD2       LYS  52  20.516  -4.288  14.152
  380   2HD   LYS  52          HD1       LYS  52  21.869  -3.169  14.276
  381   1HE   LYS  52          HE2       LYS  52  22.759  -5.280  14.789
  382   2HE   LYS  52          HE1       LYS  52  22.566  -4.471  16.341
  383   1HZ   LYS  52          HZ1       LYS  52  21.823  -6.868  16.199
  384   2HZ   LYS  52          HZ2       LYS  52  20.509  -6.316  15.272
  385   3HZ   LYS  52          HZ3       LYS  52  20.716  -5.774  16.866
  386    H    HIS  53           HN       HIS  53  16.653  -2.256  19.113
  387    HA   HIS  53           HA       HIS  53  16.300  -4.912  20.155
  388   1HB   HIS  53          HB2       HIS  53  16.365  -2.930  21.622
  389   2HB   HIS  53          HB1       HIS  53  14.875  -2.353  20.889
  390    HD1  HIS  53           HD1      HIS  53  13.412  -2.466  22.917
  391    HD2  HIS  53           HD2      HIS  53  15.368  -6.054  22.173
  392    HE1  HIS  53           HE1      HIS  53  12.358  -4.143  24.469
  393    HE2  HIS  53           HE2      HIS  53  13.734  -6.232  24.175
  394    H    ALA  54           HN       ALA  54  14.596  -2.838  17.940
  395    HA   ALA  54           HA       ALA  54  12.024  -3.903  18.114
  396   1HB   ALA  54          HB1       ALA  54  11.640  -3.015  15.904
  397   2HB   ALA  54          HB2       ALA  54  13.376  -2.901  15.615
  398   3HB   ALA  54          HB3       ALA  54  12.618  -1.880  16.836
  399    H    THR  55           HN       THR  55  14.825  -5.072  16.311
  400    HA   THR  55           HA       THR  55  13.390  -7.089  14.885
  401    HB   THR  55           HB       THR  55  15.728  -7.965  14.414
  402    HG1  THR  55           HG1      THR  55  17.432  -6.530  15.044
  403   1HG2  THR  55          HG21      THR  55  15.176  -5.054  13.826
  404   2HG2  THR  55          HG22      THR  55  14.603  -6.430  12.880
  405   3HG2  THR  55          HG23      THR  55  16.330  -6.074  12.967
  406    H    ARG  56           HN       ARG  56  15.583  -7.095  17.657
  407    HA   ARG  56           HA       ARG  56  15.441  -9.840  18.237
  408   1HB   ARG  56          HB2       ARG  56  16.011  -7.479  20.034
  409   2HB   ARG  56          HB1       ARG  56  16.289  -9.160  20.476
  410   1HG   ARG  56          HG2       ARG  56  17.984  -9.405  18.841
  411   2HG   ARG  56          HG1       ARG  56  17.564  -7.870  18.079
  412   1HD   ARG  56          HD2       ARG  56  19.608  -7.752  19.468
  413   2HD   ARG  56          HD1       ARG  56  18.339  -6.646  19.992
  414    HE   ARG  56           HE       ARG  56  18.472  -9.225  21.336
  415   1HH1  ARG  56          HH11      ARG  56  19.251  -5.818  21.366
  416   2HH1  ARG  56          HH12      ARG  56  19.462  -5.740  23.088
  417   1HH2  ARG  56          HH21      ARG  56  18.772  -9.153  23.600
  418   2HH2  ARG  56          HH22      ARG  56  19.235  -7.654  24.357
  419    H    HIS  57           HN       HIS  57  13.463  -7.111  19.232
  420    HA   HIS  57           HA       HIS  57  11.908  -8.404  21.176
  421   1HB   HIS  57          HB2       HIS  57  11.868  -6.012  21.022
  422   2HB   HIS  57          HB1       HIS  57  11.318  -6.068  19.353
  423    HD1  HIS  57           HD1      HIS  57   9.967  -7.261  22.738
  424    HD2  HIS  57           HD2      HIS  57   8.726  -5.602  19.134
  425    HE1  HIS  57           HE1      HIS  57   7.465  -6.886  22.941
  426    H    PHE  58           HN       PHE  58  11.592  -8.209  17.665
  427    HA   PHE  58           HA       PHE  58   9.126  -9.542  17.433
  428   1HB   PHE  58          HB2       PHE  58   9.929  -8.471  15.482
  429   2HB   PHE  58          HB1       PHE  58  11.490  -9.278  15.580
  430    HD1  PHE  58           HD1      PHE  58   7.935 -10.444  15.538
  431    HD2  PHE  58           HD2      PHE  58  11.818 -10.703  13.833
  432    HE1  PHE  58           HE1      PHE  58   7.141 -12.195  14.004
  433    HE2  PHE  58           HE2      PHE  58  11.035 -12.452  12.295
  434    HZ   PHE  58           HZ       PHE  58   8.692 -13.203  12.381
  435    H    HIS  59           HN       HIS  59  12.450 -10.740  17.576
  436    HA   HIS  59           HA       HIS  59  11.830 -13.473  17.269
  437   1HB   HIS  59          HB2       HIS  59  14.091 -12.686  16.954
  438   2HB   HIS  59          HB1       HIS  59  14.167 -12.098  18.611
  439    HD1  HIS  59           HD1      HIS  59  13.704 -15.441  16.825
  440    HD2  HIS  59           HD2      HIS  59  15.361 -13.845  20.294
  441    HE1  HIS  59           HE1      HIS  59  14.847 -17.362  17.983
  442    HE2  HIS  59           HE2      HIS  59  15.732 -16.402  20.141
  443    H    ALA  60           HN       ALA  60  11.852 -11.349  20.053
  444    HA   ALA  60           HA       ALA  60  11.702 -13.464  21.979
  445   1HB   ALA  60          HB1       ALA  60  12.728 -11.301  22.498
  446   2HB   ALA  60          HB2       ALA  60  11.426 -11.703  23.618
  447   3HB   ALA  60          HB3       ALA  60  11.152 -10.524  22.336
  448    H    THR  61           HN       THR  61   9.332 -11.093  20.741
  449    HA   THR  61           HA       THR  61   7.269 -12.447  22.323
  450    HB   THR  61           HB       THR  61   5.861 -10.449  21.727
  451    HG1  THR  61           HG1      THR  61   8.368  -9.519  20.712
  452   1HG2  THR  61          HG21      THR  61   6.977  -8.958  23.313
  453   2HG2  THR  61          HG22      THR  61   8.462  -9.898  23.161
  454   3HG2  THR  61          HG23      THR  61   7.026 -10.629  23.878
  455    H    GLY  62           HN       GLY  62   8.218 -11.920  19.022
  456   1HA   GLY  62          HA2       GLY  62   7.414 -13.017  17.139
  457   2HA   GLY  62          HA1       GLY  62   6.125 -13.698  18.120
  458    H    HIS  63           HN       HIS  63   7.048 -10.322  17.485
  459    HA   HIS  63           HA       HIS  63   4.317  -9.876  16.475
  460   1HB   HIS  63          HB2       HIS  63   6.207  -7.931  17.830
  461   2HB   HIS  63          HB1       HIS  63   4.661  -7.479  17.115
  462    HD2  HIS  63           HD2      HIS  63   3.198 -10.275  18.366
  463    HE1  HIS  63           HE1      HIS  63   3.967  -8.281  22.006
  464    HE2  HIS  63           HE2      HIS  63   2.833 -10.272  20.922
  465    HA   PRO  64           HA       PRO  64   6.991  -9.567  12.875
  466   1HB   PRO  64          HB2       PRO  64   5.284 -10.558  11.084
  467   2HB   PRO  64          HB1       PRO  64   6.004 -11.586  12.331
  468   1HG   PRO  64          HG2       PRO  64   3.279 -10.354  12.234
  469   2HG   PRO  64          HG1       PRO  64   3.750 -11.988  12.733
  470   1HD   PRO  64          HD2       PRO  64   3.254  -9.898  14.465
  471   2HD   PRO  64          HD1       PRO  64   4.248 -11.315  14.854
  472    H    ILE  65           HN       ILE  65   4.218  -7.677  13.514
  473    HA   ILE  65           HA       ILE  65   4.734  -6.160  11.048
  474    HB   ILE  65           HB       ILE  65   2.051  -6.600  12.353
  475   1HG1  ILE  65          HG12      ILE  65   3.200  -7.267   9.636
  476   2HG1  ILE  65          HG11      ILE  65   2.720  -8.406  10.889
  477   1HG2  ILE  65          HG21      ILE  65   2.265  -4.255  11.700
  478   2HG2  ILE  65          HG22      ILE  65   1.137  -5.101  10.641
  479   3HG2  ILE  65          HG23      ILE  65   2.770  -4.743  10.082
  480   1HD1  ILE  65          HD11      ILE  65   0.399  -7.768  10.599
  481   2HD1  ILE  65          HD12      ILE  65   1.100  -8.293   9.067
  482   3HD1  ILE  65          HD13      ILE  65   0.865  -6.575   9.388
  483    H    ILE  66           HN       ILE  66   5.236  -4.144  11.233
  484    HA   ILE  66           HA       ILE  66   4.890  -2.798  13.827
  485    HB   ILE  66           HB       ILE  66   7.080  -1.598  13.122
  486   1HG1  ILE  66          HG12      ILE  66   7.318  -4.176  11.554
  487   2HG1  ILE  66          HG11      ILE  66   7.102  -2.581  10.846
  488   1HG2  ILE  66          HG21      ILE  66   7.109  -4.464  14.061
  489   2HG2  ILE  66          HG22      ILE  66   6.885  -3.038  15.075
  490   3HG2  ILE  66          HG23      ILE  66   8.424  -3.306  14.256
  491   1HD1  ILE  66          HD11      ILE  66   9.452  -3.361  12.545
  492   2HD1  ILE  66          HD12      ILE  66   9.246  -1.886  11.597
  493   3HD1  ILE  66          HD13      ILE  66   9.423  -3.438  10.784
  494    H    GLU  67           HN       GLU  67   4.188  -0.764  13.794
  495    HA   GLU  67           HA       GLU  67   3.427   0.486  11.276
  496   1HB   GLU  67          HB2       GLU  67   1.765   0.525  13.014
  497   2HB   GLU  67          HB1       GLU  67   2.919   1.124  14.189
  498   1HG   GLU  67          HG2       GLU  67   1.536   2.938  13.659
  499   2HG   GLU  67          HG1       GLU  67   3.048   3.231  12.807
  500    H    GLY  68           HN       GLY  68   4.178   2.546  10.654
  501   1HA   GLY  68          HA2       GLY  68   6.884   3.130  11.479
  502   2HA   GLY  68          HA1       GLY  68   5.954   3.988  10.260
  503    H    TYR  69           HN       TYR  69   7.067   3.990  13.464
  504    HA   TYR  69           HA       TYR  69   5.128   5.927  14.405
  505   1HB   TYR  69          HB2       TYR  69   6.228   4.051  15.798
  506   2HB   TYR  69          HB1       TYR  69   7.637   5.106  15.855
  507    HD1  TYR  69           HD1      TYR  69   7.370   7.411  16.876
  508    HD2  TYR  69           HD2      TYR  69   4.415   4.378  17.247
  509    HE1  TYR  69           HE1      TYR  69   6.391   8.603  18.785
  510    HE2  TYR  69           HE2      TYR  69   3.427   5.566  19.157
  511    HH   TYR  69           HH       TYR  69   4.405   7.285  20.957
  512    H    ASP  70           HN       ASP  70   8.451   5.808  13.312
  513    HA   ASP  70           HA       ASP  70   9.089   8.511  13.908
  514   1HB   ASP  70          HB2       ASP  70  10.992   7.263  13.614
  515   2HB   ASP  70          HB1       ASP  70  10.329   6.348  12.269
  516    HA   PRO  71           HA       PRO  71   7.090   9.572   9.830
  517   1HB   PRO  71          HB2       PRO  71   6.881   7.770   7.813
  518   2HB   PRO  71          HB1       PRO  71   8.370   8.663   8.135
  519   1HG   PRO  71          HG2       PRO  71   7.838   5.826   8.476
  520   2HG   PRO  71          HG1       PRO  71   9.381   6.687   8.590
  521   1HD   PRO  71          HD2       PRO  71   7.547   5.843  10.735
  522   2HD   PRO  71          HD1       PRO  71   9.265   6.288  10.829
  523    HA   PRO  72           HA       PRO  72   3.414   7.184  11.393
  524   1HB   PRO  72          HB2       PRO  72   2.293   9.751  12.168
  525   2HB   PRO  72          HB1       PRO  72   2.729   8.378  13.188
  526   1HG   PRO  72          HG2       PRO  72   4.078  10.743  13.209
  527   2HG   PRO  72          HG1       PRO  72   4.830   9.186  13.601
  528   1HD   PRO  72          HD2       PRO  72   4.940  10.759  11.055
  529   2HD   PRO  72          HD1       PRO  72   6.230   9.856  11.880
  530    H    GLU  73           HN       GLU  73   3.291   7.049   8.965
  531    HA   GLU  73           HA       GLU  73   1.270   8.886   7.877
  532   1HB   GLU  73          HB2       GLU  73   3.126   7.006   6.409
  533   2HB   GLU  73          HB1       GLU  73   2.049   8.187   5.676
  534   1HG   GLU  73          HG2       GLU  73   3.320   9.987   6.783
  535   2HG   GLU  73          HG1       GLU  73   4.430   8.774   7.422
  536    H    GLY  74           HN       GLY  74   1.652   5.820   9.150
  537   1HA   GLY  74          HA2       GLY  74  -0.031   4.224   9.432
  538   2HA   GLY  74          HA1       GLY  74  -0.952   5.001   8.150
  539    H    TRP  75           HN       TRP  75   1.763   2.889   8.848
  540    HA   TRP  75           HA       TRP  75   1.201   1.325   6.502
  541   1HB   TRP  75          HB2       TRP  75   3.489   1.522   5.542
  542   2HB   TRP  75          HB1       TRP  75   2.565   3.014   5.433
  543    HD1  TRP  75           HD1      TRP  75   3.349   5.059   6.998
  544    HE1  TRP  75           HE1      TRP  75   5.618   5.590   8.087
  545    HE3  TRP  75           HE3      TRP  75   5.514   0.443   6.619
  546    HZ2  TRP  75           HZ2      TRP  75   8.018   4.217   8.698
  547    HZ3  TRP  75           HZ3      TRP  75   7.797   0.135   7.481
  548    HH2  TRP  75           HH2      TRP  75   9.022   1.985   8.499
  549    H    GLY  76           HN       GLY  76   2.344  -0.686   6.501
  550   1HA   GLY  76          HA2       GLY  76   3.516  -1.287   9.142
  551   2HA   GLY  76          HA1       GLY  76   2.316  -2.333   8.400
  552    H    TRP  77           HN       TRP  77   5.341  -2.371   9.156
  553    HA   TRP  77           HA       TRP  77   6.274  -3.619   6.668
  554   1HB   TRP  77          HB2       TRP  77   7.813  -2.008   7.707
  555   2HB   TRP  77          HB1       TRP  77   7.776  -2.924   9.208
  556    HD1  TRP  77           HD1      TRP  77   9.365  -5.016   9.399
  557    HE1  TRP  77           HE1      TRP  77  11.236  -5.967   7.898
  558    HE3  TRP  77           HE3      TRP  77   8.464  -2.302   5.159
  559    HZ2  TRP  77           HZ2      TRP  77  12.193  -5.608   5.274
  560    HZ3  TRP  77           HZ3      TRP  77   9.907  -2.666   3.200
  561    HH2  TRP  77           HH2      TRP  77  11.732  -4.285   3.258
  562    H    CYS  78           HN       CYS  78   6.284  -5.768   6.481
  563    HA   CYS  78           HA       CYS  78   5.651  -7.359   8.872
  564   1HB   CYS  78          HB2       CYS  78   4.550  -7.385   6.333
  565   2HB   CYS  78          HB1       CYS  78   5.653  -8.755   6.291
  566    H    TYR  79           HN       TYR  79   7.429  -8.054   9.873
  567    HA   TYR  79           HA       TYR  79  10.005  -7.871   8.998
  568   1HB   TYR  79          HB2       TYR  79   8.732  -9.566  11.100
  569   2HB   TYR  79          HB1       TYR  79  10.442  -9.775  10.744
  570    HD1  TYR  79           HD1      TYR  79  11.817  -7.507  10.676
  571    HD2  TYR  79           HD2      TYR  79   8.142  -8.058  12.750
  572    HE1  TYR  79           HE1      TYR  79  12.380  -5.630  12.160
  573    HE2  TYR  79           HE2      TYR  79   8.693  -6.177  14.235
  574    HH   TYR  79           HH       TYR  79  10.784  -5.031  15.038
  575    H    VAL  80           HN       VAL  80   8.507 -11.102   9.344
  576    HA   VAL  80           HA       VAL  80  10.625 -12.403   8.049
  577    HB   VAL  80           HB       VAL  80   9.065 -14.364   7.866
  578   1HG1  VAL  80          HG11      VAL  80   9.271 -13.003  10.548
  579   2HG1  VAL  80          HG12      VAL  80  10.484 -14.049   9.809
  580   3HG1  VAL  80          HG13      VAL  80   8.923 -14.713  10.291
  581   1HG2  VAL  80          HG21      VAL  80   6.895 -14.225   8.975
  582   2HG2  VAL  80          HG22      VAL  80   6.973 -13.121   7.601
  583   3HG2  VAL  80          HG23      VAL  80   7.134 -12.498   9.243
  584    H    ASP  81           HN       ASP  81   7.852 -10.830   6.746
  585    HA   ASP  81           HA       ASP  81   7.965 -12.196   4.202
  586   1HB   ASP  81          HB2       ASP  81   6.432  -9.697   4.943
  587   2HB   ASP  81          HB1       ASP  81   6.158 -10.722   3.539
  588    H    GLU  82           HN       GLU  82   9.122  -9.281   5.668
  589    HA   GLU  82           HA       GLU  82  10.463  -7.592   5.028
  590   1HB   GLU  82          HB2       GLU  82  11.183  -9.528   2.833
  591   2HB   GLU  82          HB1       GLU  82  11.987  -7.980   3.064
  592   1HG   GLU  82          HG2       GLU  82  12.600  -8.694   5.351
  593   2HG   GLU  82          HG1       GLU  82  11.900 -10.276   5.005
  594    H    VAL  83           HN       VAL  83   7.702  -7.769   4.085
  595    HA   VAL  83           HA       VAL  83   7.936  -5.943   1.791
  596    HB   VAL  83           HB       VAL  83   5.624  -6.527   1.174
  597   1HG1  VAL  83          HG11      VAL  83   7.475  -8.898   1.355
  598   2HG1  VAL  83          HG12      VAL  83   7.468  -7.671   0.087
  599   3HG1  VAL  83          HG13      VAL  83   6.089  -8.754   0.274
  600   1HG2  VAL  83          HG21      VAL  83   4.530  -8.480   2.163
  601   2HG2  VAL  83          HG22      VAL  83   4.799  -7.216   3.363
  602   3HG2  VAL  83          HG23      VAL  83   5.849  -8.632   3.324
  603    H    MET  84           HN       MET  84   6.746  -4.069   1.800
  604    HA   MET  84           HA       MET  84   5.658  -3.266   4.410
  605   1HB   MET  84          HB2       MET  84   7.574  -1.952   3.508
  606   2HB   MET  84          HB1       MET  84   6.603  -1.548   2.101
  607   1HG   MET  84          HG2       MET  84   5.003  -0.392   3.562
  608   2HG   MET  84          HG1       MET  84   6.029  -0.761   4.948
  609   1HE   MET  84          HE1       MET  84   8.505   0.191   5.241
  610   2HE   MET  84          HE2       MET  84   9.284   1.264   4.078
  611   3HE   MET  84          HE3       MET  84   8.946  -0.411   3.643
  612    H    PHE  85           HN       PHE  85   3.648  -2.180   4.473
  613    HA   PHE  85           HA       PHE  85   2.132  -1.933   1.999
  614   1HB   PHE  85          HB2       PHE  85   0.148  -3.067   3.128
  615   2HB   PHE  85          HB1       PHE  85   1.449  -4.130   2.605
  616    HD1  PHE  85           HD1      PHE  85  -0.191  -2.591   5.507
  617    HD2  PHE  85           HD2      PHE  85   2.757  -5.354   4.175
  618    HE1  PHE  85           HE1      PHE  85  -0.027  -3.507   7.783
  619    HE2  PHE  85           HE2      PHE  85   2.929  -6.272   6.447
  620    HZ   PHE  85           HZ       PHE  85   1.544  -5.343   8.257
  621    H    ASP  86           HN       ASP  86  -0.060  -0.832   2.531
  622    HA   ASP  86           HA       ASP  86   0.614   1.350   4.357
  623   1HB   ASP  86          HB2       ASP  86  -0.828   2.733   3.161
  624   2HB   ASP  86          HB1       ASP  86  -0.188   1.682   1.904
  625    H    LEU  87           HN       LEU  87  -0.734   2.050   5.974
  626    HA   LEU  87           HA       LEU  87  -3.035   0.357   6.661
  627   1HB   LEU  87          HB2       LEU  87  -0.764   1.176   8.472
  628   2HB   LEU  87          HB1       LEU  87  -2.315   0.636   9.084
  629    HG   LEU  87           HG       LEU  87  -0.455  -1.014   7.371
  630   1HD1  LEU  87          HD11      LEU  87   0.451  -0.630   9.598
  631   2HD1  LEU  87          HD12      LEU  87  -0.082  -2.302   9.419
  632   3HD1  LEU  87          HD13      LEU  87  -1.071  -1.153  10.320
  633   1HD2  LEU  87          HD21      LEU  87  -1.965  -2.857   7.912
  634   2HD2  LEU  87          HD22      LEU  87  -2.813  -1.578   7.043
  635   3HD2  LEU  87          HD23      LEU  87  -3.019  -1.745   8.787
  636    H    SER  88           HN       SER  88  -2.986   2.866   5.363
  637    HA   SER  88           HA       SER  88  -3.082   5.121   6.983
  638   1HB   SER  88          HB2       SER  88  -3.002   5.158   4.507
  639   2HB   SER  88          HB1       SER  88  -4.678   4.615   4.460
  640    HG   SER  88           HG       SER  88  -3.799   7.005   5.736
  641    H    ASP  89           HN       ASP  89  -5.636   2.789   6.231
  642    HA   ASP  89           HA       ASP  89  -7.747   4.309   7.389
  643   1HB   ASP  89          HB2       ASP  89  -7.467   1.426   6.593
  644   2HB   ASP  89          HB1       ASP  89  -8.900   1.993   7.442
  645    H    ARG  90           HN       ARG  90  -5.266   2.398   8.763
  646    HA   ARG  90           HA       ARG  90  -6.700   2.343  11.344
  647   1HB   ARG  90          HB2       ARG  90  -4.856   0.203  10.253
  648   2HB   ARG  90          HB1       ARG  90  -5.605   0.192  11.841
  649   1HG   ARG  90          HG2       ARG  90  -7.802  -0.011  10.832
  650   2HG   ARG  90          HG1       ARG  90  -7.088   0.086   9.220
  651   1HD   ARG  90          HD2       ARG  90  -5.791  -1.958   9.708
  652   2HD   ARG  90          HD1       ARG  90  -6.591  -2.068  11.274
  653    HE   ARG  90           HE       ARG  90  -8.707  -2.091   9.706
  654   1HH1  ARG  90          HH11      ARG  90  -5.647  -3.749   9.267
  655   2HH1  ARG  90          HH12      ARG  90  -6.336  -5.068   8.369
  656   1HH2  ARG  90          HH21      ARG  90  -9.619  -3.852   8.536
  657   2HH2  ARG  90          HH22      ARG  90  -8.580  -5.125   7.970
  658    H    MET  91           HN       MET  91  -4.713   4.240  10.203
  659    HA   MET  91           HA       MET  91  -2.094   3.624  10.977
  660   1HB   MET  91          HB2       MET  91  -1.590   5.981  10.650
  661   2HB   MET  91          HB1       MET  91  -2.614   5.374   9.358
  662   1HG   MET  91          HG2       MET  91  -4.548   6.427  10.348
  663   2HG   MET  91          HG1       MET  91  -3.581   6.965  11.721
  664   1HE   MET  91          HE1       MET  91  -0.854   7.813  10.279
  665   2HE   MET  91          HE2       MET  91  -1.638   8.750  11.552
  666   3HE   MET  91          HE3       MET  91  -1.151   9.537  10.051
  667    H    THR  92           HN       THR  92  -0.852   4.040  12.730
  668    HA   THR  92           HA       THR  92  -2.262   4.864  15.171
  669    HB   THR  92           HB       THR  92   0.446   3.531  14.896
  670    HG1  THR  92           HG1      THR  92  -1.570   2.319  14.289
  671   1HG2  THR  92          HG21      THR  92   0.201   4.812  16.970
  672   2HG2  THR  92          HG22      THR  92   0.209   3.079  17.295
  673   3HG2  THR  92          HG23      THR  92  -1.311   3.972  17.316
  674    HA   PRO  93           HA       PRO  93  -0.001   8.719  14.557
  675   1HB   PRO  93          HB2       PRO  93  -1.415  10.176  16.325
  676   2HB   PRO  93          HB1       PRO  93  -2.061   9.745  14.737
  677   1HG   PRO  93          HG2       PRO  93  -2.601   8.503  17.404
  678   2HG   PRO  93          HG1       PRO  93  -3.733   8.873  16.091
  679   1HD   PRO  93          HD2       PRO  93  -2.697   6.380  16.559
  680   2HD   PRO  93          HD1       PRO  93  -3.245   6.939  14.966
  681    H    HIS  94           HN       HIS  94   1.348  10.093  15.897
  682    HA   HIS  94           HA       HIS  94   2.776   8.617  17.857
  683   1HB   HIS  94          HB2       HIS  94   4.147  10.611  18.164
  684   2HB   HIS  94          HB1       HIS  94   3.881  10.318  16.454
  685    HD1  HIS  94           HD1      HIS  94   3.461  12.410  15.197
  686    HD2  HIS  94           HD2      HIS  94   2.121  12.681  19.129
  687    HE1  HIS  94           HE1      HIS  94   2.564  14.744  15.454
  688    HE2  HIS  94           HE2      HIS  94   1.924  14.937  17.885
  689    H    ASN  95           HN       ASN  95   3.037   9.062  20.102
  690    HA   ASN  95           HA       ASN  95   0.559   9.552  21.416
  691   1HB   ASN  95          HB2       ASN  95   2.276   7.969  22.257
  692   2HB   ASN  95          HB1       ASN  95   3.335   9.328  22.609
  693   1HD2  ASN  95          HD21      ASN  95   2.007   7.210  24.281
  694   2HD2  ASN  95          HD22      ASN  95   1.237   8.093  25.552
  695    H    GLY  96           HN       GLY  96   3.644  11.348  21.425
  696   1HA   GLY  96          HA2       GLY  96   2.199  13.845  21.628
  697   2HA   GLY  96          HA1       GLY  96   3.130  13.425  23.059
  698    HA   PRO  97           HA       PRO  97   5.965  15.852  20.318
  699   1HB   PRO  97          HB2       PRO  97   7.033  16.682  22.936
  700   2HB   PRO  97          HB1       PRO  97   6.506  17.673  21.573
  701   1HG   PRO  97          HG2       PRO  97   5.075  17.518  23.837
  702   2HG   PRO  97          HG1       PRO  97   4.299  17.667  22.248
  703   1HD   PRO  97          HD2       PRO  97   4.657  15.239  23.965
  704   2HD   PRO  97          HD1       PRO  97   3.249  15.743  23.004
  705    H    ILE  98           HN       ILE  98   7.435  14.519  19.523
  706    HA   ILE  98           HA       ILE  98   8.952  12.752  21.289
  707    HB   ILE  98           HB       ILE  98   8.973  12.881  18.270
  708   1HG1  ILE  98          HG12      ILE  98   7.350  11.095  20.096
  709   2HG1  ILE  98          HG11      ILE  98   6.707  12.426  19.138
  710   1HG2  ILE  98          HG21      ILE  98  10.910  11.769  19.235
  711   2HG2  ILE  98          HG22      ILE  98   9.860  10.601  18.433
  712   3HG2  ILE  98          HG23      ILE  98   9.855  10.729  20.192
  713   1HD1  ILE  98          HD11      ILE  98   7.969   9.909  18.084
  714   2HD1  ILE  98          HD12      ILE  98   7.388  11.252  17.095
  715   3HD1  ILE  98          HD13      ILE  98   6.253  10.316  18.070
  716    HA   PRO  99           HA       PRO  99  12.511  15.496  21.116
  717   1HB   PRO  99          HB2       PRO  99  13.930  13.068  22.031
  718   2HB   PRO  99          HB1       PRO  99  13.843  14.666  22.778
  719   1HG   PRO  99          HG2       PRO  99  12.537  12.576  23.819
  720   2HG   PRO  99          HG1       PRO  99  11.840  14.207  23.841
  721   1HD   PRO  99          HD2       PRO  99  11.219  11.902  22.031
  722   2HD   PRO  99          HD1       PRO  99  10.116  13.076  22.782
  723    H    ARG 100           HN       ARG 100  12.985  15.788  18.978
  724    HA   ARG 100           HA       ARG 100  13.771  13.555  17.326
  725   1HB   ARG 100          HB2       ARG 100  12.379  15.481  16.496
  726   2HB   ARG 100          HB1       ARG 100  13.816  16.490  16.616
  727   1HG   ARG 100          HG2       ARG 100  13.612  15.797  14.353
  728   2HG   ARG 100          HG1       ARG 100  14.960  14.900  15.061
  729   1HD   ARG 100          HD2       ARG 100  13.217  13.078  15.547
  730   2HD   ARG 100          HD1       ARG 100  12.199  13.938  14.393
  731    HE   ARG 100           HE       ARG 100  14.809  13.385  13.347
  732   1HH1  ARG 100          HH11      ARG 100  11.587  12.115  13.833
  733   2HH1  ARG 100          HH12      ARG 100  11.766  10.830  12.670
  734   1HH2  ARG 100          HH21      ARG 100  15.067  11.689  11.824
  735   2HH2  ARG 100          HH22      ARG 100  13.731  10.614  11.516
  736    H    TYR 101           HN       TYR 101  15.779  12.903  16.946
  737    HA   TYR 101           HA       TYR 101  17.987  14.640  17.802
  738   1HB   TYR 101          HB2       TYR 101  17.951  11.641  17.390
  739   2HB   TYR 101          HB1       TYR 101  19.340  12.582  17.928
  740    HD1  TYR 101           HD1      TYR 101  19.093  13.893  20.127
  741    HD2  TYR 101           HD2      TYR 101  16.422  10.801  18.945
  742    HE1  TYR 101           HE1      TYR 101  18.354  13.647  22.460
  743    HE2  TYR 101           HE2      TYR 101  15.675  10.550  21.272
  744    HH   TYR 101           HH       TYR 101  16.361  12.818  23.683
  745    H    VAL 102           HN       VAL 102  17.282  12.183  15.306
  746    HA   VAL 102           HA       VAL 102  18.851  13.813  13.428
  747    HB   VAL 102           HB       VAL 102  19.130  11.619  12.135
  748   1HG1  VAL 102          HG11      VAL 102  20.965  12.692  13.311
  749   2HG1  VAL 102          HG12      VAL 102  21.059  10.941  13.507
  750   3HG1  VAL 102          HG13      VAL 102  20.458  11.945  14.825
  751   1HG2  VAL 102          HG21      VAL 102  19.046   9.567  13.491
  752   2HG2  VAL 102          HG22      VAL 102  17.452  10.298  13.310
  753   3HG2  VAL 102          HG23      VAL 102  18.341  10.484  14.822
  Start of MODEL   17
    1   1H    MET   1          HT1       MET   1   6.589   0.782  -1.162
    2   2H    MET   1          HT2       MET   1   5.411   0.437  -2.332
    3   3H    MET   1          HT3       MET   1   6.592  -0.716  -1.950
    4    HA   MET   1           HA       MET   1   5.732  -1.021   0.224
    5   1HB   MET   1          HB2       MET   1   3.807   0.154   1.051
    6   2HB   MET   1          HB1       MET   1   4.975   1.351   0.508
    7   1HG   MET   1          HG2       MET   1   3.722   1.685  -1.536
    8   2HG   MET   1          HG1       MET   1   2.579   0.430  -1.062
    9   1HE   MET   1          HE1       MET   1   1.559   3.255  -1.947
   10   2HE   MET   1          HE2       MET   1   0.372   3.608  -0.692
   11   3HE   MET   1          HE3       MET   1   0.491   1.979  -1.358
   12    H    THR   2           HN       THR   2   3.926  -2.410   0.681
   13    HA   THR   2           HA       THR   2   2.459  -3.269  -1.729
   14    HB   THR   2           HB       THR   2   4.218  -4.905  -1.040
   15    HG1  THR   2           HG1      THR   2   2.717  -6.076  -2.000
   16   1HG2  THR   2          HG21      THR   2   4.255  -4.553   1.343
   17   2HG2  THR   2          HG22      THR   2   3.820  -6.233   1.021
   18   3HG2  THR   2          HG23      THR   2   2.576  -5.073   1.484
   19    H    MET   3           HN       MET   3   0.703  -5.030  -0.534
   20    HA   MET   3           HA       MET   3  -0.827  -3.240   1.227
   21   1HB   MET   3          HB2       MET   3  -1.756  -5.422  -0.641
   22   2HB   MET   3          HB1       MET   3  -2.811  -4.612   0.511
   23   1HG   MET   3          HG2       MET   3  -1.312  -3.309  -1.750
   24   2HG   MET   3          HG1       MET   3  -3.043  -3.643  -1.695
   25   1HE   MET   3          HE1       MET   3  -2.653   0.308  -1.395
   26   2HE   MET   3          HE2       MET   3  -3.309  -1.000  -2.378
   27   3HE   MET   3          HE3       MET   3  -1.564  -0.775  -2.261
   28    H    GLY   4           HN       GLY   4  -2.407  -4.528   2.664
   29   1HA   GLY   4          HA2       GLY   4  -0.935  -5.737   4.664
   30   2HA   GLY   4          HA1       GLY   4  -2.677  -5.864   4.501
   31    H    CYS   5           HN       CYS   5  -0.630  -7.782   5.407
   32    HA   CYS   5           HA       CYS   5  -1.070  -9.940   3.456
   33   1HB   CYS   5          HB2       CYS   5   0.807 -11.093   4.488
   34   2HB   CYS   5          HB1       CYS   5   1.303  -9.463   4.040
   35    H    ARG   6           HN       ARG   6  -1.253 -12.152   4.620
   36    HA   ARG   6           HA       ARG   6  -3.610 -12.329   5.981
   37   1HB   ARG   6          HB2       ARG   6  -3.081 -14.617   6.470
   38   2HB   ARG   6          HB1       ARG   6  -2.433 -14.217   4.891
   39   1HG   ARG   6          HG2       ARG   6  -0.798 -14.323   7.420
   40   2HG   ARG   6          HG1       ARG   6  -0.959 -15.653   6.277
   41   1HD   ARG   6          HD2       ARG   6   0.264 -12.946   5.760
   42   2HD   ARG   6          HD1       ARG   6   1.109 -14.487   5.868
   43    HE   ARG   6           HE       ARG   6  -0.770 -14.739   3.834
   44   1HH1  ARG   6          HH11      ARG   6   2.151 -12.910   4.503
   45   2HH1  ARG   6          HH12      ARG   6   2.506 -12.612   2.832
   46   1HH2  ARG   6          HH21      ARG   6  -0.267 -14.403   1.630
   47   2HH2  ARG   6          HH22      ARG   6   1.141 -13.485   1.193
   48    H    HIS   7           HN       HIS   7  -0.469 -11.737   7.380
   49    HA   HIS   7           HA       HIS   7  -1.104 -12.316  10.066
   50   1HB   HIS   7          HB2       HIS   7   0.993 -10.495   8.881
   51   2HB   HIS   7          HB1       HIS   7   0.877 -10.864  10.599
   52    HD2  HIS   7           HD2      HIS   7   1.043 -13.795  11.055
   53    HE1  HIS   7           HE1      HIS   7   3.651 -14.171   7.747
   54    HE2  HIS   7           HE2      HIS   7   2.862 -15.247   9.901
   55    H    VAL   8           HN       VAL   8  -1.883  -9.634   8.045
   56    HA   VAL   8           HA       VAL   8  -2.134  -7.607   9.983
   57    HB   VAL   8           HB       VAL   8  -2.609  -7.848   7.196
   58   1HG1  VAL   8          HG11      VAL   8  -4.951  -6.601   8.629
   59   2HG1  VAL   8          HG12      VAL   8  -4.993  -8.072   7.655
   60   3HG1  VAL   8          HG13      VAL   8  -4.639  -6.521   6.894
   61   1HG2  VAL   8          HG21      VAL   8  -2.503  -5.405   7.274
   62   2HG2  VAL   8          HG22      VAL   8  -1.255  -6.152   8.272
   63   3HG2  VAL   8          HG23      VAL   8  -2.691  -5.460   9.026
   64    H    ALA   9           HN       ALA   9  -4.217 -10.256   9.080
   65    HA   ALA   9           HA       ALA   9  -6.569  -9.274  10.337
   66   1HB   ALA   9          HB1       ALA   9  -5.784 -12.123   9.729
   67   2HB   ALA   9          HB2       ALA   9  -6.627 -11.031   8.631
   68   3HB   ALA   9          HB3       ALA   9  -7.405 -11.554  10.125
   69    H    GLY  10           HN       GLY  10  -3.664 -10.653  11.515
   70   1HA   GLY  10          HA2       GLY  10  -4.838 -11.589  14.005
   71   2HA   GLY  10          HA1       GLY  10  -3.149 -11.705  13.538
   72    H    ILE  11           HN       ILE  11  -2.978  -8.852  12.841
   73    HA   ILE  11           HA       ILE  11  -2.272  -7.932  15.464
   74    HB   ILE  11           HB       ILE  11  -1.501  -5.877  14.364
   75   1HG1  ILE  11          HG12      ILE  11  -2.456  -7.146  11.787
   76   2HG1  ILE  11          HG11      ILE  11  -3.290  -5.835  12.612
   77   1HG2  ILE  11          HG21      ILE  11  -0.650  -8.434  13.020
   78   2HG2  ILE  11          HG22      ILE  11   0.007  -7.749  14.507
   79   3HG2  ILE  11          HG23      ILE  11   0.248  -6.917  12.971
   80   1HD1  ILE  11          HD11      ILE  11  -1.953  -5.031  10.744
   81   2HD1  ILE  11          HD12      ILE  11  -0.502  -5.704  11.489
   82   3HD1  ILE  11          HD13      ILE  11  -1.368  -4.386  12.279
   83    H    ARG  12           HN       ARG  12  -3.008  -6.046  16.496
   84    HA   ARG  12           HA       ARG  12  -5.711  -5.165  15.704
   85   1HB   ARG  12          HB2       ARG  12  -6.221  -4.856  18.080
   86   2HB   ARG  12          HB1       ARG  12  -5.762  -6.525  17.769
   87   1HG   ARG  12          HG2       ARG  12  -3.687  -6.276  18.808
   88   2HG   ARG  12          HG1       ARG  12  -3.752  -4.516  18.722
   89   1HD   ARG  12          HD2       ARG  12  -4.134  -5.198  20.989
   90   2HD   ARG  12          HD1       ARG  12  -5.636  -4.555  20.329
   91    HE   ARG  12           HE       ARG  12  -5.069  -7.435  20.656
   92   1HH1  ARG  12          HH11      ARG  12  -7.289  -4.721  20.596
   93   2HH1  ARG  12          HH12      ARG  12  -8.636  -5.654  21.170
   94   1HH2  ARG  12          HH21      ARG  12  -6.853  -8.658  21.393
   95   2HH2  ARG  12          HH22      ARG  12  -8.402  -7.891  21.591
   96    H    THR  13           HN       THR  13  -6.197  -2.918  16.740
   97    HA   THR  13           HA       THR  13  -3.955  -1.156  16.351
   98    HB   THR  13           HB       THR  13  -5.663   0.537  17.424
   99    HG1  THR  13           HG1      THR  13  -7.769  -0.088  17.296
  100   1HG2  THR  13          HG21      THR  13  -4.894   0.565  15.108
  101   2HG2  THR  13          HG22      THR  13  -6.617   0.932  15.217
  102   3HG2  THR  13          HG23      THR  13  -6.086  -0.667  14.693
  103    H    VAL  14           HN       VAL  14  -2.513  -0.654  17.815
  104    HA   VAL  14           HA       VAL  14  -3.023  -1.560  20.565
  105    HB   VAL  14           HB       VAL  14  -0.525  -1.712  20.752
  106   1HG1  VAL  14          HG11      VAL  14  -1.820  -3.409  18.622
  107   2HG1  VAL  14          HG12      VAL  14  -1.912  -3.681  20.362
  108   3HG1  VAL  14          HG13      VAL  14  -0.364  -3.820  19.529
  109   1HG2  VAL  14          HG21      VAL  14   0.771  -1.815  18.663
  110   2HG2  VAL  14          HG22      VAL  14   0.088  -0.211  18.937
  111   3HG2  VAL  14          HG23      VAL  14  -0.655  -1.299  17.764
  112    H    THR  15           HN       THR  15  -2.051  -0.400  22.294
  113    HA   THR  15           HA       THR  15  -2.084   2.486  21.811
  114    HB   THR  15           HB       THR  15  -2.123   0.973  24.436
  115    HG1  THR  15           HG1      THR  15  -4.134   1.755  22.634
  116   1HG2  THR  15          HG21      THR  15  -2.927   3.098  25.371
  117   2HG2  THR  15          HG22      THR  15  -2.736   3.862  23.793
  118   3HG2  THR  15          HG23      THR  15  -1.321   3.270  24.664
  119    HA   PRO  16           HA       PRO  16   2.379   2.524  22.058
  120   1HB   PRO  16          HB2       PRO  16   2.637   5.233  22.370
  121   2HB   PRO  16          HB1       PRO  16   2.377   4.442  20.812
  122   1HG   PRO  16          HG2       PRO  16   0.404   5.800  22.601
  123   2HG   PRO  16          HG1       PRO  16   0.543   5.861  20.835
  124   1HD   PRO  16          HD2       PRO  16  -1.291   4.326  22.076
  125   2HD   PRO  16          HD1       PRO  16  -0.521   3.831  20.555
  126    H    SER  17           HN       SER  17   3.453   1.952  23.821
  127    HA   SER  17           HA       SER  17   2.570   2.498  26.445
  128   1HB   SER  17          HB2       SER  17   3.867   0.489  25.840
  129   2HB   SER  17          HB1       SER  17   5.273   1.500  25.511
  130    HG   SER  17           HG       SER  17   4.038   0.899  27.978
  131    H    ALA  18           HN       ALA  18   4.883   4.072  24.339
  132    HA   ALA  18           HA       ALA  18   5.046   6.302  26.193
  133   1HB   ALA  18          HB1       ALA  18   6.912   4.851  26.867
  134   2HB   ALA  18          HB2       ALA  18   7.476   6.380  26.194
  135   3HB   ALA  18          HB3       ALA  18   7.542   4.911  25.221
  136    H    LEU  19           HN       LEU  19   6.686   7.984  25.084
  137    HA   LEU  19           HA       LEU  19   5.584   8.640  22.541
  138   1HB   LEU  19          HB2       LEU  19   7.892   9.780  24.112
  139   2HB   LEU  19          HB1       LEU  19   7.384  10.426  22.564
  140    HG   LEU  19           HG       LEU  19   5.633  10.291  25.020
  141   1HD1  LEU  19          HD11      LEU  19   5.958  12.710  25.138
  142   2HD1  LEU  19          HD12      LEU  19   7.096  12.626  23.793
  143   3HD1  LEU  19          HD13      LEU  19   7.486  11.850  25.327
  144   1HD2  LEU  19          HD21      LEU  19   4.161  11.761  23.736
  145   2HD2  LEU  19          HD22      LEU  19   4.390  10.212  22.924
  146   3HD2  LEU  19          HD23      LEU  19   5.248  11.643  22.352
  147    H    GLY  20           HN       GLY  20   8.943   7.954  23.493
  148   1HA   GLY  20          HA2       GLY  20   9.439   7.069  20.732
  149   2HA   GLY  20          HA1       GLY  20  10.664   7.730  21.805
  150    H    CYS  21           HN       CYS  21  11.992   5.920  21.466
  151    HA   CYS  21           HA       CYS  21  11.148   3.261  21.912
  152   1HB   CYS  21          HB2       CYS  21  13.929   4.439  22.041
  153   2HB   CYS  21          HB1       CYS  21  13.552   2.722  21.959
  154    HG   CYS  21           HG       CYS  21  11.996   3.917  19.449
  155    H    GLU  22           HN       GLU  22  10.444   2.518  23.760
  156    HA   GLU  22           HA       GLU  22  10.691   3.581  26.289
  157   1HB   GLU  22          HB2       GLU  22  10.471   0.654  25.572
  158   2HB   GLU  22          HB1       GLU  22  10.021   1.380  27.108
  159   1HG   GLU  22          HG2       GLU  22   8.171   2.470  26.179
  160   2HG   GLU  22          HG1       GLU  22   8.747   2.220  24.530
  161    H    GLU  23           HN       GLU  23  12.679   1.101  24.755
  162    HA   GLU  23           HA       GLU  23  14.354   0.518  26.910
  163   1HB   GLU  23          HB2       GLU  23  14.223  -0.914  24.963
  164   2HB   GLU  23          HB1       GLU  23  14.865   0.362  23.939
  165   1HG   GLU  23          HG2       GLU  23  16.978   0.270  25.200
  166   2HG   GLU  23          HG1       GLU  23  16.327  -1.073  26.141
  167    H    CYS  24           HN       CYS  24  14.766   2.875  24.277
  168    HA   CYS  24           HA       CYS  24  17.348   3.686  25.059
  169   1HB   CYS  24          HB2       CYS  24  15.251   5.145  23.445
  170   2HB   CYS  24          HB1       CYS  24  16.928   5.655  23.600
  171    HG   CYS  24           HG       CYS  24  17.312   4.539  21.290
  172    H    LEU  25           HN       LEU  25  14.160   4.617  26.111
  173    HA   LEU  25           HA       LEU  25  14.851   7.108  27.267
  174   1HB   LEU  25          HB2       LEU  25  12.554   5.230  27.782
  175   2HB   LEU  25          HB1       LEU  25  12.700   6.802  28.544
  176    HG   LEU  25           HG       LEU  25  12.502   6.335  25.566
  177   1HD1  LEU  25          HD11      LEU  25  10.453   7.338  27.538
  178   2HD1  LEU  25          HD12      LEU  25  10.418   5.789  26.696
  179   3HD1  LEU  25          HD13      LEU  25  10.259   7.291  25.786
  180   1HD2  LEU  25          HD21      LEU  25  12.467   8.879  27.188
  181   2HD2  LEU  25          HD22      LEU  25  12.200   8.760  25.449
  182   3HD2  LEU  25          HD23      LEU  25  13.771   8.340  26.130
  183    H    LYS  26           HN       LYS  26  15.317   3.858  28.356
  184    HA   LYS  26           HA       LYS  26  15.262   4.440  31.156
  185   1HB   LYS  26          HB2       LYS  26  15.960   2.206  31.510
  186   2HB   LYS  26          HB1       LYS  26  14.912   2.158  30.100
  187   1HG   LYS  26          HG2       LYS  26  16.930   2.159  28.661
  188   2HG   LYS  26          HG1       LYS  26  17.918   2.069  30.117
  189   1HD   LYS  26          HD2       LYS  26  15.856   0.039  29.273
  190   2HD   LYS  26          HD1       LYS  26  17.601  -0.131  29.074
  191   1HE   LYS  26          HE2       LYS  26  17.826   0.103  31.551
  192   2HE   LYS  26          HE1       LYS  26  16.068   0.060  31.661
  193   1HZ   LYS  26          HZ1       LYS  26  16.144  -2.139  30.574
  194   2HZ   LYS  26          HZ2       LYS  26  16.933  -2.112  32.071
  195   3HZ   LYS  26          HZ3       LYS  26  17.838  -2.093  30.635
  196    H    ILE  27           HN       ILE  27  17.614   4.872  28.690
  197    HA   ILE  27           HA       ILE  27  19.644   5.426  30.758
  198    HB   ILE  27           HB       ILE  27  21.376   4.846  29.015
  199   1HG1  ILE  27          HG12      ILE  27  19.005   3.516  27.680
  200   2HG1  ILE  27          HG11      ILE  27  19.879   4.911  27.056
  201   1HG2  ILE  27          HG21      ILE  27  19.589   2.644  30.029
  202   2HG2  ILE  27          HG22      ILE  27  20.929   3.392  30.895
  203   3HG2  ILE  27          HG23      ILE  27  21.239   2.432  29.449
  204   1HD1  ILE  27          HD11      ILE  27  20.549   2.878  25.922
  205   2HD1  ILE  27          HD12      ILE  27  21.008   2.152  27.462
  206   3HD1  ILE  27          HD13      ILE  27  21.894   3.547  26.845
  207    H    GLY  28           HN       GLY  28  17.730   6.765  28.420
  208   1HA   GLY  28          HA2       GLY  28  17.708   8.914  27.561
  209   2HA   GLY  28          HA1       GLY  28  19.234   9.215  28.382
  210    H    SER  29           HN       SER  29  18.311   6.816  25.952
  211    HA   SER  29           HA       SER  29  20.613   7.648  24.337
  212   1HB   SER  29          HB2       SER  29  20.534   5.275  24.973
  213   2HB   SER  29          HB1       SER  29  18.940   5.120  24.239
  214    HG   SER  29           HG       SER  29  20.087   5.867  22.244
  215    HA   PRO  30           HA       PRO  30  17.823   9.354  21.303
  216   1HB   PRO  30          HB2       PRO  30  19.524   9.470  19.204
  217   2HB   PRO  30          HB1       PRO  30  19.625  10.588  20.569
  218   1HG   PRO  30          HG2       PRO  30  21.235   8.125  20.017
  219   2HG   PRO  30          HG1       PRO  30  21.780   9.711  20.597
  220   1HD   PRO  30          HD2       PRO  30  21.402   7.593  22.250
  221   2HD   PRO  30          HD1       PRO  30  21.152   9.272  22.768
  222    H    TRP  31           HN       TRP  31  17.124   8.855  19.015
  223    HA   TRP  31           HA       TRP  31  17.557   6.133  18.134
  224   1HB   TRP  31          HB2       TRP  31  15.079   5.707  17.976
  225   2HB   TRP  31          HB1       TRP  31  15.718   5.729  19.615
  226    HD1  TRP  31           HD1      TRP  31  13.744   8.038  17.205
  227    HE1  TRP  31           HE1      TRP  31  12.233   9.562  18.627
  228    HE3  TRP  31           HE3      TRP  31  15.294   6.608  21.863
  229    HZ2  TRP  31           HZ2      TRP  31  11.755  10.080  21.354
  230    HZ3  TRP  31           HZ3      TRP  31  14.255   7.665  23.825
  231    HH2  TRP  31           HH2      TRP  31  12.522   9.367  23.574
  232    H    VAL  32           HN       VAL  32  16.673   5.749  15.993
  233    HA   VAL  32           HA       VAL  32  16.761   8.188  14.404
  234    HB   VAL  32           HB       VAL  32  16.719   5.323  13.435
  235   1HG1  VAL  32          HG11      VAL  32  16.034   6.903  11.736
  236   2HG1  VAL  32          HG12      VAL  32  17.649   6.295  11.369
  237   3HG1  VAL  32          HG13      VAL  32  17.449   7.905  12.059
  238   1HG2  VAL  32          HG21      VAL  32  19.141   5.548  13.151
  239   2HG2  VAL  32          HG22      VAL  32  18.670   5.700  14.844
  240   3HG2  VAL  32          HG23      VAL  32  19.081   7.138  13.911
  241    H    HIS  33           HN       HIS  33  14.857   5.174  14.121
  242    HA   HIS  33           HA       HIS  33  12.479   6.855  13.720
  243   1HB   HIS  33          HB2       HIS  33  13.195   4.340  12.196
  244   2HB   HIS  33          HB1       HIS  33  11.640   5.157  12.100
  245    HD1  HIS  33           HD1      HIS  33  14.579   4.842  10.230
  246    HD2  HIS  33           HD2      HIS  33  12.235   8.096  11.350
  247    HE1  HIS  33           HE1      HIS  33  15.141   6.682   8.605
  248    HE2  HIS  33           HE2      HIS  33  13.826   8.685   9.398
  249    H    LEU  34           HN       LEU  34  10.571   6.082  14.547
  250    HA   LEU  34           HA       LEU  34  10.855   3.986  16.558
  251   1HB   LEU  34          HB2       LEU  34   8.615   5.946  16.068
  252   2HB   LEU  34          HB1       LEU  34   8.703   4.812  17.403
  253    HG   LEU  34           HG       LEU  34  10.591   7.111  16.916
  254   1HD1  LEU  34          HD11      LEU  34   8.437   6.686  18.975
  255   2HD1  LEU  34          HD12      LEU  34   8.384   7.824  17.628
  256   3HD1  LEU  34          HD13      LEU  34   9.561   8.044  18.923
  257   1HD2  LEU  34          HD21      LEU  34  11.704   5.202  17.960
  258   2HD2  LEU  34          HD22      LEU  34  10.441   5.137  19.191
  259   3HD2  LEU  34          HD23      LEU  34  11.513   6.535  19.099
  260    H    ARG  35           HN       ARG  35   9.916   2.059  16.377
  261    HA   ARG  35           HA       ARG  35   7.708   1.788  14.464
  262   1HB   ARG  35          HB2       ARG  35   9.894  -0.243  14.970
  263   2HB   ARG  35          HB1       ARG  35   8.468  -0.520  13.979
  264   1HG   ARG  35          HG2       ARG  35   9.218   1.371  12.517
  265   2HG   ARG  35          HG1       ARG  35  10.720   1.407  13.444
  266   1HD   ARG  35          HD2       ARG  35  10.995  -1.031  12.871
  267   2HD   ARG  35          HD1       ARG  35   9.641  -0.845  11.762
  268    HE   ARG  35           HE       ARG  35  11.243   1.059  10.865
  269   1HH1  ARG  35          HH11      ARG  35  11.957  -2.231  11.807
  270   2HH1  ARG  35          HH12      ARG  35  13.345  -2.379  10.763
  271   1HH2  ARG  35          HH21      ARG  35  13.085   0.881   9.483
  272   2HH2  ARG  35          HH22      ARG  35  14.003  -0.604   9.478
  273    H    ILE  36           HN       ILE  36   5.915   1.245  15.441
  274    HA   ILE  36           HA       ILE  36   6.059   0.229  18.191
  275    HB   ILE  36           HB       ILE  36   4.747   2.249  17.958
  276   1HG1  ILE  36          HG12      ILE  36   2.942  -0.145  18.364
  277   2HG1  ILE  36          HG11      ILE  36   4.017   0.534  19.581
  278   1HG2  ILE  36          HG21      ILE  36   4.133   2.110  15.624
  279   2HG2  ILE  36          HG22      ILE  36   2.688   2.314  16.614
  280   3HG2  ILE  36          HG23      ILE  36   3.087   0.728  15.955
  281   1HD1  ILE  36          HD11      ILE  36   1.722   1.236  19.929
  282   2HD1  ILE  36          HD12      ILE  36   1.680   1.939  18.312
  283   3HD1  ILE  36          HD13      ILE  36   2.752   2.613  19.539
  284    H    CYS  37           HN       CYS  37   5.580  -1.717  18.663
  285    HA   CYS  37           HA       CYS  37   5.119  -3.619  16.594
  286   1HB   CYS  37          HB2       CYS  37   6.576  -3.967  18.549
  287   2HB   CYS  37          HB1       CYS  37   5.165  -3.923  19.590
  288    H    ARG  38           HN       ARG  38   3.194  -4.088  15.763
  289    HA   ARG  38           HA       ARG  38   0.806  -3.003  16.891
  290   1HB   ARG  38          HB2       ARG  38   1.356  -4.698  14.467
  291   2HB   ARG  38          HB1       ARG  38  -0.265  -4.181  14.907
  292   1HG   ARG  38          HG2       ARG  38   2.017  -2.285  14.420
  293   2HG   ARG  38          HG1       ARG  38   0.857  -2.775  13.183
  294   1HD   ARG  38          HD2       ARG  38   0.249  -1.324  15.759
  295   2HD   ARG  38          HD1       ARG  38   0.194  -0.651  14.129
  296    HE   ARG  38           HE       ARG  38  -1.600  -2.827  14.994
  297   1HH1  ARG  38          HH11      ARG  38  -1.076   0.310  13.514
  298   2HH1  ARG  38          HH12      ARG  38  -2.728   0.461  12.979
  299   1HH2  ARG  38          HH21      ARG  38  -3.750  -2.629  14.283
  300   2HH2  ARG  38          HH22      ARG  38  -4.242  -1.220  13.404
  301    H    THR  39           HN       THR  39   2.322  -5.610  17.974
  302    HA   THR  39           HA       THR  39  -0.130  -7.194  18.285
  303    HB   THR  39           HB       THR  39   2.653  -8.124  18.973
  304    HG1  THR  39           HG1      THR  39   1.519  -9.026  16.603
  305   1HG2  THR  39          HG21      THR  39   0.094  -9.592  18.324
  306   2HG2  THR  39          HG22      THR  39   0.822  -9.424  19.922
  307   3HG2  THR  39          HG23      THR  39   1.649 -10.348  18.667
  308    H    CYS  40           HN       CYS  40   2.407  -5.540  20.097
  309    HA   CYS  40           HA       CYS  40   0.899  -6.125  22.551
  310   1HB   CYS  40          HB2       CYS  40   2.980  -6.368  23.807
  311   2HB   CYS  40          HB1       CYS  40   2.920  -7.521  22.484
  312    H    GLY  41           HN       GLY  41   1.912  -3.746  20.508
  313   1HA   GLY  41          HA2       GLY  41   1.477  -1.492  20.701
  314   2HA   GLY  41          HA1       GLY  41   0.965  -1.778  22.354
  315    H    HIS  42           HN       HIS  42   4.094  -2.960  21.741
  316    HA   HIS  42           HA       HIS  42   5.139  -0.723  23.300
  317   1HB   HIS  42          HB2       HIS  42   6.112  -3.521  22.827
  318   2HB   HIS  42          HB1       HIS  42   7.207  -2.280  23.430
  319    HD1  HIS  42           HD1      HIS  42   6.823  -1.410  25.834
  320    HD2  HIS  42           HD2      HIS  42   4.163  -4.387  24.652
  321    HE1  HIS  42           HE1      HIS  42   5.676  -2.177  27.937
  322    HE2  HIS  42           HE2      HIS  42   3.965  -3.865  27.183
  323    H    VAL  43           HN       VAL  43   6.887   0.486  22.708
  324    HA   VAL  43           HA       VAL  43   7.247   0.651  19.803
  325    HB   VAL  43           HB       VAL  43   8.093   2.638  21.921
  326   1HG1  VAL  43          HG11      VAL  43   8.228   4.209  20.032
  327   2HG1  VAL  43          HG12      VAL  43   7.850   2.889  18.924
  328   3HG1  VAL  43          HG13      VAL  43   9.347   2.857  19.857
  329   1HG2  VAL  43          HG21      VAL  43   5.681   2.392  21.955
  330   2HG2  VAL  43          HG22      VAL  43   5.611   2.598  20.205
  331   3HG2  VAL  43          HG23      VAL  43   6.119   3.940  21.231
  332    H    GLY  44           HN       GLY  44   9.061   0.009  18.860
  333   1HA   GLY  44          HA2       GLY  44  11.400  -0.474  20.598
  334   2HA   GLY  44          HA1       GLY  44  10.960  -1.518  19.254
  335    H    CYS  45           HN       CYS  45  13.435  -0.055  19.802
  336    HA   CYS  45           HA       CYS  45  13.669   2.006  17.851
  337   1HB   CYS  45          HB2       CYS  45  16.175   1.503  18.199
  338   2HB   CYS  45          HB1       CYS  45  15.258   2.097  19.580
  339    HG   CYS  45           HG       CYS  45  16.118   0.231  21.112
  340    H    CYS  46           HN       CYS  46  13.976   1.836  15.750
  341    HA   CYS  46           HA       CYS  46  13.571  -0.652  14.468
  342   1HB   CYS  46          HB2       CYS  46  13.820   0.667  12.394
  343   2HB   CYS  46          HB1       CYS  46  12.718   1.421  13.543
  344    HG   CYS  46           HG       CYS  46  14.867   2.984  11.975
  345    H    ASP  47           HN       ASP  47  14.983  -1.110  12.427
  346    HA   ASP  47           HA       ASP  47  17.557  -1.887  13.364
  347   1HB   ASP  47          HB2       ASP  47  17.796  -2.582  10.851
  348   2HB   ASP  47          HB1       ASP  47  16.717  -3.471  11.919
  349    H    ASP  48           HN       ASP  48  16.442   0.994  12.064
  350    HA   ASP  48           HA       ASP  48  18.842   1.821  10.738
  351   1HB   ASP  48          HB2       ASP  48  16.805   3.628  12.063
  352   2HB   ASP  48          HB1       ASP  48  17.953   4.068  10.810
  353    H    SER  49           HN       SER  49  17.817   1.472  13.973
  354    HA   SER  49           HA       SER  49  19.782   3.321  15.070
  355   1HB   SER  49          HB2       SER  49  17.548   3.270  16.078
  356   2HB   SER  49          HB1       SER  49  17.712   1.545  16.399
  357    HG   SER  49           HG       SER  49  19.021   3.718  17.626
  358    HA   PRO  50           HA       PRO  50  22.878   0.189  15.777
  359   1HB   PRO  50          HB2       PRO  50  23.986   1.174  18.082
  360   2HB   PRO  50          HB1       PRO  50  24.337   1.806  16.470
  361   1HG   PRO  50          HG2       PRO  50  22.438   2.841  18.540
  362   2HG   PRO  50          HG1       PRO  50  23.561   3.739  17.499
  363   1HD   PRO  50          HD2       PRO  50  20.937   3.595  16.947
  364   2HD   PRO  50          HD1       PRO  50  22.160   3.604  15.659
  365    H    HIS  51           HN       HIS  51  20.291   0.806  17.906
  366    HA   HIS  51           HA       HIS  51  20.933  -1.259  19.816
  367   1HB   HIS  51          HB2       HIS  51  18.626   0.580  19.363
  368   2HB   HIS  51          HB1       HIS  51  18.363  -0.868  20.323
  369    HD1  HIS  51           HD1      HIS  51  18.323  -0.188  22.674
  370    HD2  HIS  51           HD2      HIS  51  21.322   1.774  20.556
  371    HE1  HIS  51           HE1      HIS  51  19.517   1.250  24.358
  372    HE2  HIS  51           HE2      HIS  51  21.494   2.187  23.107
  373    H    LYS  52           HN       LYS  52  18.396  -0.864  17.342
  374    HA   LYS  52           HA       LYS  52  17.094  -2.328  16.202
  375   1HB   LYS  52          HB2       LYS  52  19.448  -4.186  16.576
  376   2HB   LYS  52          HB1       LYS  52  18.113  -4.454  15.467
  377   1HG   LYS  52          HG2       LYS  52  18.850  -2.104  14.542
  378   2HG   LYS  52          HG1       LYS  52  20.385  -2.553  15.286
  379   1HD   LYS  52          HD2       LYS  52  18.856  -4.110  13.202
  380   2HD   LYS  52          HD1       LYS  52  20.387  -3.263  12.980
  381   1HE   LYS  52          HE2       LYS  52  21.495  -4.791  14.491
  382   2HE   LYS  52          HE1       LYS  52  19.964  -5.586  14.857
  383   1HZ   LYS  52          HZ1       LYS  52  19.818  -6.289  12.549
  384   2HZ   LYS  52          HZ2       LYS  52  21.254  -6.850  13.256
  385   3HZ   LYS  52          HZ3       LYS  52  21.289  -5.523  12.196
  386    H    HIS  53           HN       HIS  53  16.510  -2.191  18.940
  387    HA   HIS  53           HA       HIS  53  16.298  -4.825  20.032
  388   1HB   HIS  53          HB2       HIS  53  16.374  -2.769  21.438
  389   2HB   HIS  53          HB1       HIS  53  14.770  -2.346  20.850
  390    HD1  HIS  53           HD1      HIS  53  12.967  -2.995  22.417
  391    HD2  HIS  53           HD2      HIS  53  16.255  -5.531  22.704
  392    HE1  HIS  53           HE1      HIS  53  12.398  -4.646  24.221
  393    HE2  HIS  53           HE2      HIS  53  14.491  -6.007  24.536
  394    H    ALA  54           HN       ALA  54  14.390  -2.927  17.870
  395    HA   ALA  54           HA       ALA  54  11.882  -4.162  18.301
  396   1HB   ALA  54          HB1       ALA  54  12.943  -2.842  15.806
  397   2HB   ALA  54          HB2       ALA  54  12.093  -2.036  17.125
  398   3HB   ALA  54          HB3       ALA  54  11.254  -3.227  16.131
  399    H    THR  55           HN       THR  55  14.539  -4.867  16.052
  400    HA   THR  55           HA       THR  55  13.193  -6.946  14.676
  401    HB   THR  55           HB       THR  55  15.563  -7.580  13.964
  402    HG1  THR  55           HG1      THR  55  17.169  -6.613  14.943
  403   1HG2  THR  55          HG21      THR  55  14.588  -4.752  13.549
  404   2HG2  THR  55          HG22      THR  55  14.189  -6.161  12.565
  405   3HG2  THR  55          HG23      THR  55  15.837  -5.537  12.583
  406    H    ARG  56           HN       ARG  56  15.560  -6.928  17.311
  407    HA   ARG  56           HA       ARG  56  15.704  -9.736  17.614
  408   1HB   ARG  56          HB2       ARG  56  16.224  -7.626  19.719
  409   2HB   ARG  56          HB1       ARG  56  16.836  -9.276  19.709
  410   1HG   ARG  56          HG2       ARG  56  18.126  -8.772  17.681
  411   2HG   ARG  56          HG1       ARG  56  17.536  -7.111  17.735
  412   1HD   ARG  56          HD2       ARG  56  19.702  -7.105  18.702
  413   2HD   ARG  56          HD1       ARG  56  18.549  -6.930  20.025
  414    HE   ARG  56           HE       ARG  56  19.182  -9.656  19.645
  415   1HH1  ARG  56          HH11      ARG  56  20.518  -6.681  20.930
  416   2HH1  ARG  56          HH12      ARG  56  21.609  -7.501  22.011
  417   1HH2  ARG  56          HH21      ARG  56  20.640 -10.728  21.039
  418   2HH2  ARG  56          HH22      ARG  56  21.706  -9.791  22.047
  419    H    HIS  57           HN       HIS  57  13.454  -7.351  18.698
  420    HA   HIS  57           HA       HIS  57  12.241  -8.749  20.819
  421   1HB   HIS  57          HB2       HIS  57  11.818  -6.400  20.550
  422   2HB   HIS  57          HB1       HIS  57  11.183  -6.641  18.928
  423    HD1  HIS  57           HD1      HIS  57  10.245  -7.244  22.561
  424    HD2  HIS  57           HD2      HIS  57   8.524  -7.171  18.771
  425    HE1  HIS  57           HE1      HIS  57   7.736  -7.378  22.905
  426    H    PHE  58           HN       PHE  58  11.797  -8.885  17.333
  427    HA   PHE  58           HA       PHE  58   9.398 -10.368  17.325
  428   1HB   PHE  58          HB2       PHE  58  10.064  -9.320  15.285
  429   2HB   PHE  58          HB1       PHE  58  11.621 -10.142  15.295
  430    HD1  PHE  58           HD1      PHE  58   8.049 -11.219  15.562
  431    HD2  PHE  58           HD2      PHE  58  11.807 -11.708  13.649
  432    HE1  PHE  58           HE1      PHE  58   7.110 -13.033  14.193
  433    HE2  PHE  58           HE2      PHE  58  10.878 -13.521  12.273
  434    HZ   PHE  58           HZ       PHE  58   8.526 -14.188  12.546
  435    H    HIS  59           HN       HIS  59  12.796 -11.373  17.283
  436    HA   HIS  59           HA       HIS  59  12.278 -14.132  17.016
  437   1HB   HIS  59          HB2       HIS  59  14.495 -12.990  16.625
  438   2HB   HIS  59          HB1       HIS  59  14.680 -12.894  18.374
  439    HD1  HIS  59           HD1      HIS  59  15.382 -15.015  19.608
  440    HD2  HIS  59           HD2      HIS  59  14.677 -15.614  15.551
  441    HE1  HIS  59           HE1      HIS  59  16.254 -17.321  19.098
  442    HE2  HIS  59           HE2      HIS  59  15.942 -17.606  16.612
  443    H    ALA  60           HN       ALA  60  12.188 -11.978  19.722
  444    HA   ALA  60           HA       ALA  60  12.294 -14.071  21.702
  445   1HB   ALA  60          HB1       ALA  60  11.622 -11.152  22.023
  446   2HB   ALA  60          HB2       ALA  60  13.231 -11.860  22.169
  447   3HB   ALA  60          HB3       ALA  60  11.969 -12.292  23.322
  448    H    THR  61           HN       THR  61   9.783 -11.741  20.660
  449    HA   THR  61           HA       THR  61   7.838 -13.183  22.286
  450    HB   THR  61           HB       THR  61   6.295 -11.297  21.582
  451    HG1  THR  61           HG1      THR  61   8.761 -10.228  20.611
  452   1HG2  THR  61          HG21      THR  61   8.827 -10.532  23.040
  453   2HG2  THR  61          HG22      THR  61   7.437 -11.346  23.758
  454   3HG2  THR  61          HG23      THR  61   7.272  -9.700  23.141
  455    H    GLY  62           HN       GLY  62   8.740 -12.938  18.974
  456   1HA   GLY  62          HA2       GLY  62   7.875 -14.011  17.123
  457   2HA   GLY  62          HA1       GLY  62   6.684 -14.765  18.174
  458    H    HIS  63           HN       HIS  63   7.293 -11.325  17.647
  459    HA   HIS  63           HA       HIS  63   4.504 -11.045  16.732
  460   1HB   HIS  63          HB2       HIS  63   6.327  -9.043  18.093
  461   2HB   HIS  63          HB1       HIS  63   4.734  -8.655  17.461
  462    HD2  HIS  63           HD2      HIS  63   4.130 -11.928  19.007
  463    HE1  HIS  63           HE1      HIS  63   3.768  -9.130  22.170
  464    HE2  HIS  63           HE2      HIS  63   3.221 -11.495  21.408
  465    HA   PRO  64           HA       PRO  64   6.957 -10.477  13.046
  466   1HB   PRO  64          HB2       PRO  64   5.081 -11.087  11.241
  467   2HB   PRO  64          HB1       PRO  64   5.780 -12.309  12.311
  468   1HG   PRO  64          HG2       PRO  64   3.155 -10.888  12.513
  469   2HG   PRO  64          HG1       PRO  64   3.531 -12.594  12.812
  470   1HD   PRO  64          HD2       PRO  64   3.271 -10.683  14.783
  471   2HD   PRO  64          HD1       PRO  64   4.190 -12.191  14.959
  472    H    ILE  65           HN       ILE  65   4.329  -8.416  13.906
  473    HA   ILE  65           HA       ILE  65   4.933  -6.744  11.557
  474    HB   ILE  65           HB       ILE  65   2.240  -7.110  12.867
  475   1HG1  ILE  65          HG12      ILE  65   3.268  -7.666  10.074
  476   2HG1  ILE  65          HG11      ILE  65   2.826  -8.868  11.282
  477   1HG2  ILE  65          HG21      ILE  65   2.581  -4.750  12.347
  478   2HG2  ILE  65          HG22      ILE  65   1.397  -5.465  11.253
  479   3HG2  ILE  65          HG23      ILE  65   3.044  -5.168  10.697
  480   1HD1  ILE  65          HD11      ILE  65   0.508  -8.136  11.168
  481   2HD1  ILE  65          HD12      ILE  65   1.106  -8.623   9.582
  482   3HD1  ILE  65          HD13      ILE  65   0.949  -6.912   9.977
  483    H    ILE  66           HN       ILE  66   5.695  -4.842  11.938
  484    HA   ILE  66           HA       ILE  66   4.949  -3.443  14.418
  485    HB   ILE  66           HB       ILE  66   7.182  -2.346  14.389
  486   1HG1  ILE  66          HG12      ILE  66   7.870  -4.491  12.368
  487   2HG1  ILE  66          HG11      ILE  66   7.698  -2.777  12.005
  488   1HG2  ILE  66          HG21      ILE  66   7.226  -5.345  14.649
  489   2HG2  ILE  66          HG22      ILE  66   6.730  -4.200  15.894
  490   3HG2  ILE  66          HG23      ILE  66   8.406  -4.234  15.344
  491   1HD1  ILE  66          HD11      ILE  66   9.749  -4.014  13.822
  492   2HD1  ILE  66          HD12      ILE  66   9.564  -2.287  13.507
  493   3HD1  ILE  66          HD13      ILE  66  10.026  -3.379  12.199
  494    H    GLU  67           HN       GLU  67   4.558  -1.251  14.208
  495    HA   GLU  67           HA       GLU  67   4.054  -0.390  11.448
  496   1HB   GLU  67          HB2       GLU  67   2.158  -0.481  13.027
  497   2HB   GLU  67          HB1       GLU  67   2.985   0.661  14.073
  498   1HG   GLU  67          HG2       GLU  67   2.945   2.262  12.113
  499   2HG   GLU  67          HG1       GLU  67   1.816   1.136  11.356
  500    H    GLY  68           HN       GLY  68   4.802   1.588  10.673
  501   1HA   GLY  68          HA2       GLY  68   7.095   2.741  11.968
  502   2HA   GLY  68          HA1       GLY  68   6.313   3.336  10.507
  503    H    TYR  69           HN       TYR  69   6.710   3.743  13.855
  504    HA   TYR  69           HA       TYR  69   4.240   5.180  14.289
  505   1HB   TYR  69          HB2       TYR  69   5.383   3.671  15.986
  506   2HB   TYR  69          HB1       TYR  69   6.587   4.939  16.176
  507    HD1  TYR  69           HD1      TYR  69   6.214   5.520  18.435
  508    HD2  TYR  69           HD2      TYR  69   2.943   5.447  15.716
  509    HE1  TYR  69           HE1      TYR  69   4.791   6.594  20.128
  510    HE2  TYR  69           HE2      TYR  69   1.512   6.523  17.400
  511    HH   TYR  69           HH       TYR  69   1.359   6.899  19.714
  512    H    ASP  70           HN       ASP  70   7.677   5.911  13.994
  513    HA   ASP  70           HA       ASP  70   7.297   8.718  14.438
  514   1HB   ASP  70          HB2       ASP  70   9.435   7.878  15.046
  515   2HB   ASP  70          HB1       ASP  70   9.674   7.143  13.466
  516    HA   PRO  71           HA       PRO  71   8.022   8.971   9.609
  517   1HB   PRO  71          HB2       PRO  71   6.968   6.321   8.793
  518   2HB   PRO  71          HB1       PRO  71   8.333   7.238   8.145
  519   1HG   PRO  71          HG2       PRO  71   8.736   5.084   9.659
  520   2HG   PRO  71          HG1       PRO  71   9.779   6.512   9.806
  521   1HD   PRO  71          HD2       PRO  71   7.536   5.610  11.573
  522   2HD   PRO  71          HD1       PRO  71   9.110   6.303  12.012
  523    HA   PRO  72           HA       PRO  72   3.647   9.981   9.916
  524   1HB   PRO  72          HB2       PRO  72   4.327  11.812   7.706
  525   2HB   PRO  72          HB1       PRO  72   3.646  12.172   9.295
  526   1HG   PRO  72          HG2       PRO  72   6.173  12.810   8.688
  527   2HG   PRO  72          HG1       PRO  72   5.722  12.257  10.312
  528   1HD   PRO  72          HD2       PRO  72   7.027  10.733   8.086
  529   2HD   PRO  72          HD1       PRO  72   7.399  10.725   9.824
  530    H    GLU  73           HN       GLU  73   5.321   8.456   7.467
  531    HA   GLU  73           HA       GLU  73   3.522   8.460   5.313
  532   1HB   GLU  73          HB2       GLU  73   5.315   6.201   6.214
  533   2HB   GLU  73          HB1       GLU  73   4.622   6.403   4.613
  534   1HG   GLU  73          HG2       GLU  73   5.957   8.384   4.251
  535   2HG   GLU  73          HG1       GLU  73   6.602   8.272   5.890
  536    H    GLY  74           HN       GLY  74   3.759   6.413   8.187
  537   1HA   GLY  74          HA2       GLY  74   2.158   5.099   9.209
  538   2HA   GLY  74          HA1       GLY  74   0.989   5.679   8.030
  539    H    TRP  75           HN       TRP  75   3.633   3.389   8.521
  540    HA   TRP  75           HA       TRP  75   2.263   1.564   6.697
  541   1HB   TRP  75          HB2       TRP  75   4.549   0.847   5.820
  542   2HB   TRP  75          HB1       TRP  75   3.920   2.379   5.233
  543    HD1  TRP  75           HD1      TRP  75   5.400   4.457   5.546
  544    HE1  TRP  75           HE1      TRP  75   7.682   4.926   6.633
  545    HE3  TRP  75           HE3      TRP  75   6.063   0.000   7.971
  546    HZ2  TRP  75           HZ2      TRP  75   9.519   3.579   8.311
  547    HZ3  TRP  75           HZ3      TRP  75   8.110  -0.327   9.294
  548    HH2  TRP  75           HH2      TRP  75   9.801   1.425   9.460
  549    H    GLY  76           HN       GLY  76   3.103  -0.678   6.878
  550   1HA   GLY  76          HA2       GLY  76   4.086  -1.215   9.611
  551   2HA   GLY  76          HA1       GLY  76   2.792  -2.155   8.876
  552    H    TRP  77           HN       TRP  77   5.669  -2.660   9.828
  553    HA   TRP  77           HA       TRP  77   6.712  -3.880   7.364
  554   1HB   TRP  77          HB2       TRP  77   8.296  -2.395   8.436
  555   2HB   TRP  77          HB1       TRP  77   8.053  -3.187   9.988
  556    HD1  TRP  77           HD1      TRP  77   9.640  -5.144  10.557
  557    HE1  TRP  77           HE1      TRP  77  11.469  -6.431   9.283
  558    HE3  TRP  77           HE3      TRP  77   8.871  -3.228   5.881
  559    HZ2  TRP  77           HZ2      TRP  77  12.454  -6.610   6.641
  560    HZ3  TRP  77           HZ3      TRP  77  10.298  -4.008   4.037
  561    HH2  TRP  77           HH2      TRP  77  12.053  -5.663   4.410
  562    H    CYS  78           HN       CYS  78   6.781  -6.034   7.169
  563    HA   CYS  78           HA       CYS  78   6.107  -7.633   9.556
  564   1HB   CYS  78          HB2       CYS  78   4.524  -7.533   7.469
  565   2HB   CYS  78          HB1       CYS  78   5.697  -8.627   6.761
  566    H    TYR  79           HN       TYR  79   7.730  -8.826  10.282
  567    HA   TYR  79           HA       TYR  79  10.267  -8.750   9.133
  568   1HB   TYR  79          HB2       TYR  79   9.131 -10.571  11.246
  569   2HB   TYR  79          HB1       TYR  79  10.838 -10.529  10.817
  570    HD1  TYR  79           HD1      TYR  79  12.069  -8.315  11.062
  571    HD2  TYR  79           HD2      TYR  79   8.253  -9.044  12.794
  572    HE1  TYR  79           HE1      TYR  79  12.430  -6.459  12.628
  573    HE2  TYR  79           HE2      TYR  79   8.607  -7.186  14.365
  574    HH   TYR  79           HH       TYR  79  10.710  -6.013  15.371
  575    H    VAL  80           HN       VAL  80   8.350 -11.745   9.547
  576    HA   VAL  80           HA       VAL  80  10.094 -13.288   7.980
  577    HB   VAL  80           HB       VAL  80   8.211 -14.968   7.913
  578   1HG1  VAL  80          HG11      VAL  80   9.000 -13.842  10.598
  579   2HG1  VAL  80          HG12      VAL  80   9.925 -14.999   9.641
  580   3HG1  VAL  80          HG13      VAL  80   8.359 -15.459  10.309
  581   1HG2  VAL  80          HG21      VAL  80   6.833 -12.882   9.606
  582   2HG2  VAL  80          HG22      VAL  80   6.282 -14.541   9.375
  583   3HG2  VAL  80          HG23      VAL  80   6.327 -13.429   8.008
  584    H    ASP  81           HN       ASP  81   7.536 -11.198   7.041
  585    HA   ASP  81           HA       ASP  81   7.194 -12.408   4.426
  586   1HB   ASP  81          HB2       ASP  81   6.161  -9.756   5.456
  587   2HB   ASP  81          HB1       ASP  81   5.672 -10.545   3.967
  588    H    GLU  82           HN       GLU  82   8.853  -9.743   5.936
  589    HA   GLU  82           HA       GLU  82  10.375  -8.228   5.252
  590   1HB   GLU  82          HB2       GLU  82  10.714 -10.259   3.067
  591   2HB   GLU  82          HB1       GLU  82  11.585  -8.732   3.023
  592   1HG   GLU  82          HG2       GLU  82  12.436  -9.304   5.333
  593   2HG   GLU  82          HG1       GLU  82  11.783 -10.921   5.066
  594    H    VAL  83           HN       VAL  83   7.557  -8.061   4.502
  595    HA   VAL  83           HA       VAL  83   7.822  -6.263   2.195
  596    HB   VAL  83           HB       VAL  83   5.457  -6.562   1.736
  597   1HG1  VAL  83          HG11      VAL  83   5.485  -8.889   0.984
  598   2HG1  VAL  83          HG12      VAL  83   6.882  -9.202   2.014
  599   3HG1  VAL  83          HG13      VAL  83   7.018  -8.080   0.660
  600   1HG2  VAL  83          HG21      VAL  83   4.108  -8.236   2.920
  601   2HG2  VAL  83          HG22      VAL  83   4.637  -6.944   3.998
  602   3HG2  VAL  83          HG23      VAL  83   5.443  -8.511   4.040
  603    H    MET  84           HN       MET  84   7.088  -4.209   2.345
  604    HA   MET  84           HA       MET  84   6.120  -3.331   4.985
  605   1HB   MET  84          HB2       MET  84   8.241  -2.307   4.264
  606   2HB   MET  84          HB1       MET  84   7.472  -1.745   2.787
  607   1HG   MET  84          HG2       MET  84   5.991  -0.316   4.088
  608   2HG   MET  84          HG1       MET  84   6.731  -0.896   5.579
  609   1HE   MET  84          HE1       MET  84   9.809  -1.084   4.725
  610   2HE   MET  84          HE2       MET  84   9.248  -0.424   6.262
  611   3HE   MET  84          HE3       MET  84  10.380   0.494   5.269
  612    H    PHE  85           HN       PHE  85   4.003  -3.009   5.049
  613    HA   PHE  85           HA       PHE  85   2.640  -2.271   2.546
  614   1HB   PHE  85          HB2       PHE  85   0.595  -3.283   3.632
  615   2HB   PHE  85          HB1       PHE  85   1.868  -4.417   3.205
  616    HD1  PHE  85           HD1      PHE  85   0.036  -2.834   5.934
  617    HD2  PHE  85           HD2      PHE  85   3.163  -5.538   4.922
  618    HE1  PHE  85           HE1      PHE  85   0.023  -3.704   8.234
  619    HE2  PHE  85           HE2      PHE  85   3.159  -6.407   7.222
  620    HZ   PHE  85           HZ       PHE  85   1.588  -5.492   8.881
  621    H    ASP  86           HN       ASP  86   0.864  -0.801   2.668
  622    HA   ASP  86           HA       ASP  86   1.439   1.384   4.424
  623   1HB   ASP  86          HB2       ASP  86   0.681   1.751   2.104
  624   2HB   ASP  86          HB1       ASP  86  -0.876   1.032   2.505
  625    H    LEU  87           HN       LEU  87   0.456   2.027   6.215
  626    HA   LEU  87           HA       LEU  87  -2.041   0.703   7.043
  627   1HB   LEU  87          HB2       LEU  87   0.477   1.108   8.634
  628   2HB   LEU  87          HB1       LEU  87  -1.079   0.974   9.427
  629    HG   LEU  87           HG       LEU  87   0.183  -1.139   7.679
  630   1HD1  LEU  87          HD11      LEU  87  -0.203  -0.993  10.666
  631   2HD1  LEU  87          HD12      LEU  87   1.333  -0.888   9.807
  632   3HD1  LEU  87          HD13      LEU  87   0.406  -2.388   9.776
  633   1HD2  LEU  87          HD21      LEU  87  -2.259  -1.158   7.551
  634   2HD2  LEU  87          HD22      LEU  87  -2.354  -1.188   9.313
  635   3HD2  LEU  87          HD23      LEU  87  -1.656  -2.554   8.444
  636    H    SER  88           HN       SER  88  -1.321   3.362   5.821
  637    HA   SER  88           HA       SER  88  -1.154   5.369   7.769
  638   1HB   SER  88          HB2       SER  88  -1.836   6.911   5.933
  639   2HB   SER  88          HB1       SER  88  -0.542   5.805   5.471
  640    HG   SER  88           HG       SER  88  -1.993   4.580   4.315
  641    H    ASP  89           HN       ASP  89  -3.943   3.797   6.353
  642    HA   ASP  89           HA       ASP  89  -5.843   5.642   7.478
  643   1HB   ASP  89          HB2       ASP  89  -6.291   4.387   5.388
  644   2HB   ASP  89          HB1       ASP  89  -6.277   2.884   6.303
  645    H    ARG  90           HN       ARG  90  -4.090   2.974   8.638
  646    HA   ARG  90           HA       ARG  90  -6.039   2.493  10.805
  647   1HB   ARG  90          HB2       ARG  90  -4.159   0.449   9.620
  648   2HB   ARG  90          HB1       ARG  90  -5.433   0.163  10.791
  649   1HG   ARG  90          HG2       ARG  90  -7.124   0.595   9.133
  650   2HG   ARG  90          HG1       ARG  90  -5.893   1.053   7.952
  651   1HD   ARG  90          HD2       ARG  90  -4.952  -1.196   8.054
  652   2HD   ARG  90          HD1       ARG  90  -6.165  -1.657   9.244
  653    HE   ARG  90           HE       ARG  90  -6.995  -0.774   6.559
  654   1HH1  ARG  90          HH11      ARG  90  -6.800  -3.211   9.061
  655   2HH1  ARG  90          HH12      ARG  90  -7.861  -4.329   8.253
  656   1HH2  ARG  90          HH21      ARG  90  -8.376  -2.254   5.461
  657   2HH2  ARG  90          HH22      ARG  90  -8.754  -3.783   6.196
  658    H    MET  91           HN       MET  91  -3.607   4.274  10.677
  659    HA   MET  91           HA       MET  91  -1.547   2.762  12.036
  660   1HB   MET  91          HB2       MET  91  -0.158   4.746  11.813
  661   2HB   MET  91          HB1       MET  91  -0.892   4.319  10.277
  662   1HG   MET  91          HG2       MET  91  -2.556   6.081  10.585
  663   2HG   MET  91          HG1       MET  91  -1.805   6.512  12.122
  664   1HE   MET  91          HE1       MET  91   1.291   6.142  11.456
  665   2HE   MET  91          HE2       MET  91   0.635   7.514  12.349
  666   3HE   MET  91          HE3       MET  91   1.715   7.788  10.982
  667    H    THR  92           HN       THR  92  -0.368   3.869  13.851
  668    HA   THR  92           HA       THR  92  -2.319   4.113  15.986
  669    HB   THR  92           HB       THR  92   0.699   3.973  16.139
  670    HG1  THR  92           HG1      THR  92  -0.142   2.108  15.130
  671   1HG2  THR  92          HG21      THR  92  -0.357   4.816  18.183
  672   2HG2  THR  92          HG22      THR  92   0.304   3.201  18.433
  673   3HG2  THR  92          HG23      THR  92  -1.432   3.417  18.210
  674    HA   PRO  93           HA       PRO  93  -1.906   8.568  16.206
  675   1HB   PRO  93          HB2       PRO  93  -3.205   8.232  18.826
  676   2HB   PRO  93          HB1       PRO  93  -3.758   9.127  17.407
  677   1HG   PRO  93          HG2       PRO  93  -4.925   6.833  18.189
  678   2HG   PRO  93          HG1       PRO  93  -4.783   7.284  16.480
  679   1HD   PRO  93          HD2       PRO  93  -3.150   5.346  18.072
  680   2HD   PRO  93          HD1       PRO  93  -3.747   5.216  16.403
  681    H    HIS  94           HN       HIS  94  -0.329   9.805  17.035
  682    HA   HIS  94           HA       HIS  94   1.454   8.680  18.998
  683   1HB   HIS  94          HB2       HIS  94   2.754  10.787  18.711
  684   2HB   HIS  94          HB1       HIS  94   2.476   9.923  17.208
  685    HD1  HIS  94           HD1      HIS  94   0.752  11.011  15.529
  686    HD2  HIS  94           HD2      HIS  94   1.780  13.363  18.805
  687    HE1  HIS  94           HE1      HIS  94   0.037  13.350  14.939
  688    HE2  HIS  94           HE2      HIS  94   0.862  14.783  16.844
  689    H    ASN  95           HN       ASN  95   1.551   9.110  21.116
  690    HA   ASN  95           HA       ASN  95  -0.786  10.377  22.238
  691   1HB   ASN  95          HB2       ASN  95  -0.004   9.511  24.385
  692   2HB   ASN  95          HB1       ASN  95   0.028   8.251  23.158
  693   1HD2  ASN  95          HD21      ASN  95   2.019   7.483  22.412
  694   2HD2  ASN  95          HD22      ASN  95   3.487   7.767  23.275
  695    H    GLY  96           HN       GLY  96   1.878  11.707  21.105
  696   1HA   GLY  96          HA2       GLY  96   1.505  14.207  22.191
  697   2HA   GLY  96          HA1       GLY  96   2.716  13.432  23.206
  698    HA   PRO  97           HA       PRO  97   4.738  15.314  19.326
  699   1HB   PRO  97          HB2       PRO  97   6.159  16.876  21.401
  700   2HB   PRO  97          HB1       PRO  97   5.495  17.407  19.852
  701   1HG   PRO  97          HG2       PRO  97   4.317  18.065  22.160
  702   2HG   PRO  97          HG1       PRO  97   3.367  17.691  20.710
  703   1HD   PRO  97          HD2       PRO  97   3.915  15.986  23.108
  704   2HD   PRO  97          HD1       PRO  97   2.416  16.168  22.174
  705    H    ILE  98           HN       ILE  98   6.021  13.650  18.829
  706    HA   ILE  98           HA       ILE  98   7.651  12.353  20.823
  707    HB   ILE  98           HB       ILE  98   7.343  11.861  17.860
  708   1HG1  ILE  98          HG12      ILE  98   6.292  10.391  20.289
  709   2HG1  ILE  98          HG11      ILE  98   5.340  11.385  19.191
  710   1HG2  ILE  98          HG21      ILE  98   8.808  10.205  19.910
  711   2HG2  ILE  98          HG22      ILE  98   9.554  11.154  18.625
  712   3HG2  ILE  98          HG23      ILE  98   8.539   9.769  18.222
  713   1HD1  ILE  98          HD11      ILE  98   6.743   8.815  18.503
  714   2HD1  ILE  98          HD12      ILE  98   5.823   9.815  17.377
  715   3HD1  ILE  98          HD13      ILE  98   5.009   9.037  18.735
  716    HA   PRO  99           HA       PRO  99  11.344  14.740  19.994
  717   1HB   PRO  99          HB2       PRO  99  12.732  12.581  21.416
  718   2HB   PRO  99          HB1       PRO  99  12.583  14.287  21.846
  719   1HG   PRO  99          HG2       PRO  99  11.316  12.342  23.218
  720   2HG   PRO  99          HG1       PRO  99  10.619  13.959  23.003
  721   1HD   PRO  99          HD2       PRO  99   9.987  11.414  21.558
  722   2HD   PRO  99          HD1       PRO  99   8.887  12.683  22.139
  723    H    ARG 100           HN       ARG 100  11.894  14.547  17.888
  724    HA   ARG 100           HA       ARG 100  13.010  11.988  16.966
  725   1HB   ARG 100          HB2       ARG 100  11.104  13.036  15.694
  726   2HB   ARG 100          HB1       ARG 100  12.180  14.367  15.298
  727   1HG   ARG 100          HG2       ARG 100  13.260  11.726  14.656
  728   2HG   ARG 100          HG1       ARG 100  11.793  12.153  13.772
  729   1HD   ARG 100          HD2       ARG 100  14.246  13.886  13.972
  730   2HD   ARG 100          HD1       ARG 100  13.884  12.819  12.615
  731    HE   ARG 100           HE       ARG 100  11.732  14.608  13.144
  732   1HH1  ARG 100          HH11      ARG 100  14.872  14.377  11.599
  733   2HH1  ARG 100          HH12      ARG 100  14.571  15.721  10.527
  734   1HH2  ARG 100          HH21      ARG 100  11.331  16.343  11.715
  735   2HH2  ARG 100          HH22      ARG 100  12.562  16.811  10.580
  736    H    TYR 101           HN       TYR 101  15.135  11.847  17.092
  737    HA   TYR 101           HA       TYR 101  16.693  14.226  17.607
  738   1HB   TYR 101          HB2       TYR 101  17.468  11.304  17.568
  739   2HB   TYR 101          HB1       TYR 101  18.535  12.616  18.050
  740    HD1  TYR 101           HD1      TYR 101  18.205  13.775  20.172
  741    HD2  TYR 101           HD2      TYR 101  15.673  10.560  19.012
  742    HE1  TYR 101           HE1      TYR 101  17.389  13.592  22.483
  743    HE2  TYR 101           HE2      TYR 101  14.848  10.371  21.319
  744    HH   TYR 101           HH       TYR 101  15.565  10.930  23.580
  745    H    VAL 102           HN       VAL 102  16.154  12.091  14.941
  746    HA   VAL 102           HA       VAL 102  18.637  12.870  13.650
  747    HB   VAL 102           HB       VAL 102  17.805  11.325  11.797
  748   1HG1  VAL 102          HG11      VAL 102  19.501  10.674  13.424
  749   2HG1  VAL 102          HG12      VAL 102  18.444   9.315  13.041
  750   3HG1  VAL 102          HG13      VAL 102  18.240  10.191  14.559
  751   1HG2  VAL 102          HG21      VAL 102  15.813  10.565  13.938
  752   2HG2  VAL 102          HG22      VAL 102  16.090   9.695  12.429
  753   3HG2  VAL 102          HG23      VAL 102  15.430  11.330  12.396
  Start of MODEL   18
    1   1H    MET   1          HT1       MET   1   4.873   1.438  -3.161
    2   2H    MET   1          HT2       MET   1   5.470   1.249  -1.584
    3   3H    MET   1          HT3       MET   1   4.604   2.643  -1.999
    4    HA   MET   1           HA       MET   1   3.266   1.138  -0.693
    5   1HB   MET   1          HB2       MET   1   1.331   1.009  -2.193
    6   2HB   MET   1          HB1       MET   1   2.133   2.569  -2.303
    7   1HG   MET   1          HG2       MET   1   3.216   1.872  -4.376
    8   2HG   MET   1          HG1       MET   1   2.425   0.301  -4.261
    9   1HE   MET   1          HE1       MET   1  -0.491   1.090  -3.210
   10   2HE   MET   1          HE2       MET   1  -0.163  -0.078  -4.490
   11   3HE   MET   1          HE3       MET   1  -1.339   1.210  -4.753
   12    H    THR   2           HN       THR   2   2.306  -0.860  -0.398
   13    HA   THR   2           HA       THR   2   2.919  -3.022  -2.248
   14    HB   THR   2           HB       THR   2   3.737  -3.266   0.658
   15    HG1  THR   2           HG1      THR   2   5.410  -2.121   0.011
   16   1HG2  THR   2          HG21      THR   2   4.277  -5.018  -1.744
   17   2HG2  THR   2          HG22      THR   2   3.149  -5.374  -0.435
   18   3HG2  THR   2          HG23      THR   2   4.880  -5.296  -0.110
   19    H    MET   3           HN       MET   3   1.454  -4.714  -2.091
   20    HA   MET   3           HA       MET   3  -1.024  -4.262  -0.818
   21   1HB   MET   3          HB2       MET   3  -0.831  -5.650  -2.818
   22   2HB   MET   3          HB1       MET   3   0.163  -6.807  -1.946
   23   1HG   MET   3          HG2       MET   3  -1.730  -7.326  -0.488
   24   2HG   MET   3          HG1       MET   3  -2.725  -6.176  -1.379
   25   1HE   MET   3          HE1       MET   3  -3.445  -6.484  -3.907
   26   2HE   MET   3          HE2       MET   3  -2.927  -7.832  -4.918
   27   3HE   MET   3          HE3       MET   3  -1.750  -6.637  -4.373
   28    H    GLY   4           HN       GLY   4  -1.694  -4.689   1.191
   29   1HA   GLY   4          HA2       GLY   4   0.011  -5.619   3.224
   30   2HA   GLY   4          HA1       GLY   4  -1.741  -5.508   3.338
   31    H    CYS   5           HN       CYS   5   0.691  -7.586   3.710
   32    HA   CYS   5           HA       CYS   5  -0.173  -9.845   2.206
   33   1HB   CYS   5          HB2       CYS   5   1.473 -11.094   3.468
   34   2HB   CYS   5          HB1       CYS   5   2.158  -9.542   3.001
   35    H    ARG   6           HN       ARG   6  -0.732 -11.978   3.414
   36    HA   ARG   6           HA       ARG   6  -3.243 -11.646   4.587
   37   1HB   ARG   6          HB2       ARG   6  -3.127 -14.050   5.153
   38   2HB   ARG   6          HB1       ARG   6  -2.659 -13.715   3.493
   39   1HG   ARG   6          HG2       ARG   6  -0.291 -13.870   4.165
   40   2HG   ARG   6          HG1       ARG   6  -0.812 -14.302   5.795
   41   1HD   ARG   6          HD2       ARG   6  -1.553 -15.841   3.313
   42   2HD   ARG   6          HD1       ARG   6  -0.193 -16.245   4.358
   43    HE   ARG   6           HE       ARG   6  -2.020 -16.393   6.160
   44   1HH1  ARG   6          HH11      ARG   6  -2.577 -17.130   2.782
   45   2HH1  ARG   6          HH12      ARG   6  -3.705 -18.409   3.120
   46   1HH2  ARG   6          HH21      ARG   6  -3.494 -18.078   6.609
   47   2HH2  ARG   6          HH22      ARG   6  -4.233 -18.944   5.296
   48    H    HIS   7           HN       HIS   7  -0.101 -11.705   6.070
   49    HA   HIS   7           HA       HIS   7  -0.852 -12.185   8.737
   50   1HB   HIS   7          HB2       HIS   7   1.414 -10.499   7.664
   51   2HB   HIS   7          HB1       HIS   7   1.232 -10.969   9.347
   52    HD2  HIS   7           HD2      HIS   7   0.671 -14.127   9.009
   53    HE1  HIS   7           HE1      HIS   7   4.283 -14.077   6.808
   54    HE2  HIS   7           HE2      HIS   7   2.546 -15.555   7.924
   55    H    VAL   8           HN       VAL   8  -1.245  -9.398   6.719
   56    HA   VAL   8           HA       VAL   8  -1.356  -7.429   8.752
   57    HB   VAL   8           HB       VAL   8  -1.246  -7.266   6.062
   58   1HG1  VAL   8          HG11      VAL   8  -3.270  -6.263   5.184
   59   2HG1  VAL   8          HG12      VAL   8  -4.084  -6.517   6.728
   60   3HG1  VAL   8          HG13      VAL   8  -3.591  -7.903   5.752
   61   1HG2  VAL   8          HG21      VAL   8  -2.319  -5.132   7.896
   62   2HG2  VAL   8          HG22      VAL   8  -1.572  -4.867   6.319
   63   3HG2  VAL   8          HG23      VAL   8  -0.619  -5.531   7.646
   64    H    ALA   9           HN       ALA   9  -3.661  -9.718   7.514
   65    HA   ALA   9           HA       ALA   9  -5.942  -8.471   8.733
   66   1HB   ALA   9          HB1       ALA   9  -7.123 -10.515   8.149
   67   2HB   ALA   9          HB2       ALA   9  -5.596 -11.299   7.747
   68   3HB   ALA   9          HB3       ALA   9  -6.168  -9.937   6.783
   69    H    GLY  10           HN       GLY  10  -3.299  -9.965  10.022
   70   1HA   GLY  10          HA2       GLY  10  -4.795 -11.186  12.243
   71   2HA   GLY  10          HA1       GLY  10  -3.128 -11.544  11.826
   72    H    ILE  11           HN       ILE  11  -3.290  -8.308  11.513
   73    HA   ILE  11           HA       ILE  11  -2.175  -7.897  14.170
   74    HB   ILE  11           HB       ILE  11  -1.632  -5.610  13.398
   75   1HG1  ILE  11          HG12      ILE  11  -2.820  -6.560  10.782
   76   2HG1  ILE  11          HG11      ILE  11  -3.466  -5.292  11.815
   77   1HG2  ILE  11          HG21      ILE  11  -0.022  -7.413  13.139
   78   2HG2  ILE  11          HG22      ILE  11   0.108  -6.258  11.813
   79   3HG2  ILE  11          HG23      ILE  11  -0.698  -7.806  11.558
   80   1HD1  ILE  11          HD11      ILE  11  -1.579  -3.884  11.343
   81   2HD1  ILE  11          HD12      ILE  11  -2.281  -4.453   9.824
   82   3HD1  ILE  11          HD13      ILE  11  -0.795  -5.180  10.438
   83    H    ARG  12           HN       ARG  12  -2.910  -6.288  15.605
   84    HA   ARG  12           HA       ARG  12  -5.730  -5.553  15.199
   85   1HB   ARG  12          HB2       ARG  12  -5.977  -5.644  17.666
   86   2HB   ARG  12          HB1       ARG  12  -5.574  -7.202  16.961
   87   1HG   ARG  12          HG2       ARG  12  -3.272  -6.964  17.667
   88   2HG   ARG  12          HG1       ARG  12  -3.610  -5.350  18.295
   89   1HD   ARG  12          HD2       ARG  12  -5.171  -6.293  19.911
   90   2HD   ARG  12          HD1       ARG  12  -4.877  -7.908  19.268
   91    HE   ARG  12           HE       ARG  12  -2.464  -7.442  19.981
   92   1HH1  ARG  12          HH11      ARG  12  -5.285  -6.203  21.655
   93   2HH1  ARG  12          HH12      ARG  12  -4.492  -6.122  23.198
   94   1HH2  ARG  12          HH21      ARG  12  -1.428  -7.352  22.013
   95   2HH2  ARG  12          HH22      ARG  12  -2.298  -6.778  23.403
   96    H    THR  13           HN       THR  13  -6.387  -3.612  16.503
   97    HA   THR  13           HA       THR  13  -4.478  -1.499  16.103
   98    HB   THR  13           HB       THR  13  -7.238  -1.366  17.339
   99    HG1  THR  13           HG1      THR  13  -7.977  -1.087  15.302
  100   1HG2  THR  13          HG21      THR  13  -5.836   0.580  17.868
  101   2HG2  THR  13          HG22      THR  13  -7.127   1.015  16.748
  102   3HG2  THR  13          HG23      THR  13  -5.481   0.793  16.154
  103    H    VAL  14           HN       VAL  14  -2.851  -1.544  17.488
  104    HA   VAL  14           HA       VAL  14  -3.320  -2.142  20.306
  105    HB   VAL  14           HB       VAL  14  -0.847  -2.305  20.441
  106   1HG1  VAL  14          HG11      VAL  14  -0.619  -4.349  19.138
  107   2HG1  VAL  14          HG12      VAL  14  -2.070  -3.937  18.226
  108   3HG1  VAL  14          HG13      VAL  14  -2.183  -4.287  19.951
  109   1HG2  VAL  14          HG21      VAL  14  -0.278  -0.705  18.684
  110   2HG2  VAL  14          HG22      VAL  14  -0.953  -1.793  17.470
  111   3HG2  VAL  14          HG23      VAL  14   0.478  -2.269  18.384
  112    H    THR  15           HN       THR  15  -2.026  -0.841  21.899
  113    HA   THR  15           HA       THR  15  -2.041   2.004  21.126
  114    HB   THR  15           HB       THR  15  -2.424   0.844  23.897
  115    HG1  THR  15           HG1      THR  15  -4.167   0.471  22.299
  116   1HG2  THR  15          HG21      THR  15  -1.492   3.114  23.890
  117   2HG2  THR  15          HG22      THR  15  -3.152   3.108  24.488
  118   3HG2  THR  15          HG23      THR  15  -2.807   3.653  22.846
  119    HA   PRO  16           HA       PRO  16   2.371   1.906  21.534
  120   1HB   PRO  16          HB2       PRO  16   2.020   4.759  22.289
  121   2HB   PRO  16          HB1       PRO  16   3.023   4.043  21.023
  122   1HG   PRO  16          HG2       PRO  16   0.762   5.322  20.422
  123   2HG   PRO  16          HG1       PRO  16   1.255   3.864  19.539
  124   1HD   PRO  16          HD2       PRO  16  -0.829   4.192  21.651
  125   2HD   PRO  16          HD1       PRO  16  -0.835   3.157  20.209
  126    H    SER  17           HN       SER  17   3.595   1.287  23.180
  127    HA   SER  17           HA       SER  17   2.858   1.405  25.878
  128   1HB   SER  17          HB2       SER  17   5.733   1.235  25.032
  129   2HB   SER  17          HB1       SER  17   4.894   0.351  26.308
  130    HG   SER  17           HG       SER  17   3.790  -0.819  24.678
  131    H    ALA  18           HN       ALA  18   4.940   3.456  23.926
  132    HA   ALA  18           HA       ALA  18   4.723   5.630  25.807
  133   1HB   ALA  18          HB1       ALA  18   7.144   5.938  26.059
  134   2HB   ALA  18          HB2       ALA  18   7.429   4.440  25.173
  135   3HB   ALA  18          HB3       ALA  18   6.620   4.398  26.740
  136    H    LEU  19           HN       LEU  19   6.357   7.451  24.848
  137    HA   LEU  19           HA       LEU  19   5.371   7.882  22.172
  138   1HB   LEU  19          HB2       LEU  19   7.187   9.540  23.928
  139   2HB   LEU  19          HB1       LEU  19   6.651  10.035  22.337
  140    HG   LEU  19           HG       LEU  19   4.271   9.871  23.242
  141   1HD1  LEU  19          HD11      LEU  19   4.742   8.547  25.230
  142   2HD1  LEU  19          HD12      LEU  19   4.017  10.096  25.662
  143   3HD1  LEU  19          HD13      LEU  19   5.751   9.844  25.868
  144   1HD2  LEU  19          HD21      LEU  19   6.151  11.915  24.414
  145   2HD2  LEU  19          HD22      LEU  19   4.401  12.084  24.267
  146   3HD2  LEU  19          HD23      LEU  19   5.403  11.983  22.819
  147    H    GLY  20           HN       GLY  20   8.527   7.506  23.716
  148   1HA   GLY  20          HA2       GLY  20   9.686   6.957  21.060
  149   2HA   GLY  20          HA1       GLY  20  10.594   7.589  22.428
  150    H    CYS  21           HN       CYS  21  12.018   5.734  21.857
  151    HA   CYS  21           HA       CYS  21  11.051   3.102  22.506
  152   1HB   CYS  21          HB2       CYS  21  12.861   3.499  20.825
  153   2HB   CYS  21          HB1       CYS  21  13.909   4.026  22.136
  154    HG   CYS  21           HG       CYS  21  13.936   1.543  23.419
  155    H    GLU  22           HN       GLU  22  10.497   2.779  24.541
  156    HA   GLU  22           HA       GLU  22  11.237   4.159  26.786
  157   1HB   GLU  22          HB2       GLU  22   9.335   2.579  26.559
  158   2HB   GLU  22          HB1       GLU  22  10.465   1.239  26.642
  159   1HG   GLU  22          HG2       GLU  22  10.375   3.224  28.862
  160   2HG   GLU  22          HG1       GLU  22   9.129   1.984  28.743
  161    H    GLU  23           HN       GLU  23  12.752   1.222  25.499
  162    HA   GLU  23           HA       GLU  23  14.554   0.656  27.498
  163   1HB   GLU  23          HB2       GLU  23  14.216  -0.786  25.556
  164   2HB   GLU  23          HB1       GLU  23  14.979   0.409  24.516
  165   1HG   GLU  23          HG2       GLU  23  17.083   0.117  25.718
  166   2HG   GLU  23          HG1       GLU  23  16.318  -1.077  26.764
  167    H    CYS  24           HN       CYS  24  15.218   2.759  24.658
  168    HA   CYS  24           HA       CYS  24  17.840   3.351  25.597
  169   1HB   CYS  24          HB2       CYS  24  17.944   4.951  23.734
  170   2HB   CYS  24          HB1       CYS  24  17.368   3.374  23.215
  171    HG   CYS  24           HG       CYS  24  15.973   6.319  22.867
  172    H    LEU  25           HN       LEU  25  14.722   4.805  26.014
  173    HA   LEU  25           HA       LEU  25  15.445   7.387  26.788
  174   1HB   LEU  25          HB2       LEU  25  13.119   5.623  27.474
  175   2HB   LEU  25          HB1       LEU  25  13.279   7.220  28.180
  176    HG   LEU  25           HG       LEU  25  13.203   6.710  25.206
  177   1HD1  LEU  25          HD11      LEU  25  10.902   7.530  25.298
  178   2HD1  LEU  25          HD12      LEU  25  10.993   7.595  27.058
  179   3HD1  LEU  25          HD13      LEU  25  11.088   6.043  26.226
  180   1HD2  LEU  25          HD21      LEU  25  12.938   9.222  26.854
  181   2HD2  LEU  25          HD22      LEU  25  12.770   9.120  25.101
  182   3HD2  LEU  25          HD23      LEU  25  14.324   8.772  25.860
  183    H    LYS  26           HN       LYS  26  15.703   4.378  28.550
  184    HA   LYS  26           HA       LYS  26  15.656   5.522  31.155
  185   1HB   LYS  26          HB2       LYS  26  16.259   3.390  31.976
  186   2HB   LYS  26          HB1       LYS  26  15.255   3.083  30.567
  187   1HG   LYS  26          HG2       LYS  26  17.300   2.712  29.235
  188   2HG   LYS  26          HG1       LYS  26  18.256   2.925  30.702
  189   1HD   LYS  26          HD2       LYS  26  16.175   0.797  30.221
  190   2HD   LYS  26          HD1       LYS  26  17.923   0.562  30.221
  191   1HE   LYS  26          HE2       LYS  26  17.986   1.277  32.582
  192   2HE   LYS  26          HE1       LYS  26  16.230   1.422  32.564
  193   1HZ   LYS  26          HZ1       LYS  26  16.651  -0.668  33.468
  194   2HZ   LYS  26          HZ2       LYS  26  17.873  -1.025  32.346
  195   3HZ   LYS  26          HZ3       LYS  26  16.251  -1.002  31.852
  196    H    ILE  27           HN       ILE  27  18.110   5.247  28.744
  197    HA   ILE  27           HA       ILE  27  20.109   6.192  30.696
  198    HB   ILE  27           HB       ILE  27  21.835   5.296  29.103
  199   1HG1  ILE  27          HG12      ILE  27  19.434   3.886  27.913
  200   2HG1  ILE  27          HG11      ILE  27  20.396   5.129  27.120
  201   1HG2  ILE  27          HG21      ILE  27  21.649   3.002  29.899
  202   2HG2  ILE  27          HG22      ILE  27  19.965   3.283  30.334
  203   3HG2  ILE  27          HG23      ILE  27  21.248   4.152  31.174
  204   1HD1  ILE  27          HD11      ILE  27  22.335   3.659  27.155
  205   2HD1  ILE  27          HD12      ILE  27  20.972   2.911  26.322
  206   3HD1  ILE  27          HD13      ILE  27  21.382   2.414  27.964
  207    H    GLY  28           HN       GLY  28  18.146   7.274  28.375
  208   1HA   GLY  28          HA2       GLY  28  18.107   9.205  27.127
  209   2HA   GLY  28          HA1       GLY  28  19.610   9.661  27.915
  210    H    SER  29           HN       SER  29  18.827   6.913  25.819
  211    HA   SER  29           HA       SER  29  21.109   7.608  24.127
  212   1HB   SER  29          HB2       SER  29  21.009   5.300  24.929
  213   2HB   SER  29          HB1       SER  29  19.396   5.109  24.250
  214    HG   SER  29           HG       SER  29  21.818   5.539  22.813
  215    HA   PRO  30           HA       PRO  30  18.243   9.483  21.290
  216   1HB   PRO  30          HB2       PRO  30  20.485   9.569  19.410
  217   2HB   PRO  30          HB1       PRO  30  19.622  10.901  20.180
  218   1HG   PRO  30          HG2       PRO  30  22.163  10.255  20.826
  219   2HG   PRO  30          HG1       PRO  30  21.021  10.930  22.002
  220   1HD   PRO  30          HD2       PRO  30  21.888   8.090  21.614
  221   2HD   PRO  30          HD1       PRO  30  21.610   8.990  23.121
  222    H    TRP  31           HN       TRP  31  16.855   8.529  19.967
  223    HA   TRP  31           HA       TRP  31  17.659   6.117  18.541
  224   1HB   TRP  31          HB2       TRP  31  15.225   5.844  18.104
  225   2HB   TRP  31          HB1       TRP  31  15.611   5.921  19.817
  226    HD1  TRP  31           HD1      TRP  31  14.153   8.176  17.025
  227    HE1  TRP  31           HE1      TRP  31  12.561   9.874  18.127
  228    HE3  TRP  31           HE3      TRP  31  14.957   6.981  21.927
  229    HZ2  TRP  31           HZ2      TRP  31  11.746  10.600  20.725
  230    HZ3  TRP  31           HZ3      TRP  31  13.731   8.221  23.658
  231    HH2  TRP  31           HH2      TRP  31  12.158   9.994  23.070
  232    H    VAL  32           HN       VAL  32  16.981   5.841  16.294
  233    HA   VAL  32           HA       VAL  32  17.138   8.376  14.816
  234    HB   VAL  32           HB       VAL  32  17.563   5.582  13.740
  235   1HG1  VAL  32          HG11      VAL  32  16.897   7.218  12.060
  236   2HG1  VAL  32          HG12      VAL  32  18.580   6.738  11.838
  237   3HG1  VAL  32          HG13      VAL  32  18.197   8.294  12.576
  238   1HG2  VAL  32          HG21      VAL  32  19.275   6.065  15.389
  239   2HG2  VAL  32          HG22      VAL  32  19.602   7.623  14.632
  240   3HG2  VAL  32          HG23      VAL  32  19.969   6.129  13.769
  241    H    HIS  33           HN       HIS  33  15.494   5.222  14.750
  242    HA   HIS  33           HA       HIS  33  13.081   6.580  13.822
  243   1HB   HIS  33          HB2       HIS  33  14.348   4.189  12.486
  244   2HB   HIS  33          HB1       HIS  33  12.656   4.616  12.263
  245    HD1  HIS  33           HD1      HIS  33  12.415   7.333  11.455
  246    HD2  HIS  33           HD2      HIS  33  15.904   5.232  10.556
  247    HE1  HIS  33           HE1      HIS  33  13.503   8.580   9.558
  248    HE2  HIS  33           HE2      HIS  33  15.534   7.220   8.943
  249    H    LEU  34           HN       LEU  34  11.137   5.459  14.274
  250    HA   LEU  34           HA       LEU  34  11.412   3.444  16.415
  251   1HB   LEU  34          HB2       LEU  34   9.480   5.767  16.353
  252   2HB   LEU  34          HB1       LEU  34   9.542   4.521  17.584
  253    HG   LEU  34           HG       LEU  34  11.716   6.539  17.029
  254   1HD1  LEU  34          HD11      LEU  34   9.730   6.334  19.287
  255   2HD1  LEU  34          HD12      LEU  34   9.741   7.558  18.016
  256   3HD1  LEU  34          HD13      LEU  34  11.060   7.488  19.185
  257   1HD2  LEU  34          HD21      LEU  34  12.723   5.679  19.080
  258   2HD2  LEU  34          HD22      LEU  34  12.598   4.423  17.848
  259   3HD2  LEU  34          HD23      LEU  34  11.457   4.455  19.192
  260    H    ARG  35           HN       ARG  35  10.072   1.739  16.267
  261    HA   ARG  35           HA       ARG  35   7.773   1.970  14.449
  262   1HB   ARG  35          HB2       ARG  35   9.805  -0.233  14.610
  263   2HB   ARG  35          HB1       ARG  35   8.167  -0.576  14.077
  264   1HG   ARG  35          HG2       ARG  35   9.294  -0.239  12.091
  265   2HG   ARG  35          HG1       ARG  35   8.559   1.335  12.386
  266   1HD   ARG  35          HD2       ARG  35  11.098   1.279  13.663
  267   2HD   ARG  35          HD1       ARG  35  11.298   0.696  12.012
  268    HE   ARG  35           HE       ARG  35  10.204   3.327  12.776
  269   1HH1  ARG  35          HH11      ARG  35  11.633   1.187  10.388
  270   2HH1  ARG  35          HH12      ARG  35  11.957   2.471   9.264
  271   1HH2  ARG  35          HH21      ARG  35  10.638   5.007  11.308
  272   2HH2  ARG  35          HH22      ARG  35  11.375   4.639   9.764
  273    H    ILE  36           HN       ILE  36   5.898   1.086  15.119
  274    HA   ILE  36           HA       ILE  36   5.861   0.051  17.877
  275    HB   ILE  36           HB       ILE  36   4.476   2.014  17.619
  276   1HG1  ILE  36          HG12      ILE  36   2.768  -0.480  17.749
  277   2HG1  ILE  36          HG11      ILE  36   3.674   0.207  19.093
  278   1HG2  ILE  36          HG21      ILE  36   3.051   0.532  15.415
  279   2HG2  ILE  36          HG22      ILE  36   4.095   1.940  15.222
  280   3HG2  ILE  36          HG23      ILE  36   2.565   2.088  16.088
  281   1HD1  ILE  36          HD11      ILE  36   2.299   2.209  19.001
  282   2HD1  ILE  36          HD12      ILE  36   1.314   0.763  19.219
  283   3HD1  ILE  36          HD13      ILE  36   1.405   1.538  17.637
  284    H    CYS  37           HN       CYS  37   5.455  -1.949  18.224
  285    HA   CYS  37           HA       CYS  37   5.089  -3.791  16.072
  286   1HB   CYS  37          HB2       CYS  37   6.467  -4.212  18.082
  287   2HB   CYS  37          HB1       CYS  37   5.009  -4.187  19.063
  288    H    ARG  38           HN       ARG  38   3.158  -4.094  15.132
  289    HA   ARG  38           HA       ARG  38   0.752  -3.096  16.260
  290   1HB   ARG  38          HB2       ARG  38   1.343  -4.700  13.786
  291   2HB   ARG  38          HB1       ARG  38  -0.293  -4.234  14.227
  292   1HG   ARG  38          HG2       ARG  38   1.988  -2.334  13.718
  293   2HG   ARG  38          HG1       ARG  38   0.694  -2.721  12.582
  294   1HD   ARG  38          HD2       ARG  38   0.425  -1.356  15.257
  295   2HD   ARG  38          HD1       ARG  38   0.187  -0.634  13.667
  296    HE   ARG  38           HE       ARG  38  -1.565  -2.757  14.742
  297   1HH1  ARG  38          HH11      ARG  38  -1.085   0.224  12.956
  298   2HH1  ARG  38          HH12      ARG  38  -2.789   0.513  12.754
  299   1HH2  ARG  38          HH21      ARG  38  -3.796  -2.384  14.452
  300   2HH2  ARG  38          HH22      ARG  38  -4.325  -0.975  13.587
  301    H    THR  39           HN       THR  39   2.271  -5.859  17.117
  302    HA   THR  39           HA       THR  39  -0.156  -7.472  17.273
  303    HB   THR  39           HB       THR  39   2.565  -8.287  18.279
  304    HG1  THR  39           HG1      THR  39   1.545  -8.745  15.646
  305   1HG2  THR  39          HG21      THR  39   0.676  -9.699  18.932
  306   2HG2  THR  39          HG22      THR  39   1.731 -10.546  17.799
  307   3HG2  THR  39          HG23      THR  39   0.204  -9.862  17.240
  308    H    CYS  40           HN       CYS  40   2.390  -6.303  19.471
  309    HA   CYS  40           HA       CYS  40   0.565  -6.832  21.707
  310   1HB   CYS  40          HB2       CYS  40   2.585  -6.908  23.121
  311   2HB   CYS  40          HB1       CYS  40   2.672  -8.060  21.796
  312    H    GLY  41           HN       GLY  41   2.059  -4.322  19.932
  313   1HA   GLY  41          HA2       GLY  41   1.409  -2.078  20.091
  314   2HA   GLY  41          HA1       GLY  41   0.838  -2.380  21.722
  315    H    HIS  42           HN       HIS  42   4.007  -3.547  21.087
  316    HA   HIS  42           HA       HIS  42   4.985  -1.502  22.916
  317   1HB   HIS  42          HB2       HIS  42   5.424  -4.074  23.112
  318   2HB   HIS  42          HB1       HIS  42   6.692  -3.761  21.929
  319    HD1  HIS  42           HD1      HIS  42   8.890  -3.080  22.889
  320    HD2  HIS  42           HD2      HIS  42   5.745  -2.385  25.519
  321    HE1  HIS  42           HE1      HIS  42   9.946  -2.198  24.993
  322    HE2  HIS  42           HE2      HIS  42   8.038  -1.857  26.601
  323    H    VAL  43           HN       VAL  43   6.349   0.063  22.398
  324    HA   VAL  43           HA       VAL  43   7.032   0.404  19.586
  325    HB   VAL  43           HB       VAL  43   7.421   2.330  21.888
  326   1HG1  VAL  43          HG11      VAL  43   7.613   4.035  20.151
  327   2HG1  VAL  43          HG12      VAL  43   7.451   2.795  18.908
  328   3HG1  VAL  43          HG13      VAL  43   8.858   2.799  19.971
  329   1HG2  VAL  43          HG21      VAL  43   5.060   1.798  21.601
  330   2HG2  VAL  43          HG22      VAL  43   5.174   2.176  19.881
  331   3HG2  VAL  43          HG23      VAL  43   5.400   3.448  21.081
  332    H    GLY  44           HN       GLY  44   9.094   0.466  18.791
  333   1HA   GLY  44          HA2       GLY  44  11.345   0.465  20.648
  334   2HA   GLY  44          HA1       GLY  44  11.152  -0.969  19.650
  335    H    CYS  45           HN       CYS  45  13.320   1.017  19.701
  336    HA   CYS  45           HA       CYS  45  13.143   2.521  17.284
  337   1HB   CYS  45          HB2       CYS  45  15.632   2.782  17.615
  338   2HB   CYS  45          HB1       CYS  45  14.637   3.327  18.960
  339    HG   CYS  45           HG       CYS  45  15.676   1.827  20.764
  340    H    CYS  46           HN       CYS  46  14.248   2.129  15.323
  341    HA   CYS  46           HA       CYS  46  14.006  -0.598  14.507
  342   1HB   CYS  46          HB2       CYS  46  13.495   1.520  13.144
  343   2HB   CYS  46          HB1       CYS  46  15.230   1.610  12.862
  344    HG   CYS  46           HG       CYS  46  15.229   0.046  10.832
  345    H    ASP  47           HN       ASP  47  15.858  -1.411  12.928
  346    HA   ASP  47           HA       ASP  47  18.039  -2.043  14.649
  347   1HB   ASP  47          HB2       ASP  47  18.824  -3.453  12.868
  348   2HB   ASP  47          HB1       ASP  47  17.070  -3.592  12.930
  349    H    ASP  48           HN       ASP  48  17.494   0.377  12.272
  350    HA   ASP  48           HA       ASP  48  20.172   1.049  11.670
  351   1HB   ASP  48          HB2       ASP  48  18.256   1.853  10.344
  352   2HB   ASP  48          HB1       ASP  48  17.714   2.818  11.712
  353    H    SER  49           HN       SER  49  18.149   1.604  14.405
  354    HA   SER  49           HA       SER  49  19.919   3.594  15.562
  355   1HB   SER  49          HB2       SER  49  17.528   2.175  16.773
  356   2HB   SER  49          HB1       SER  49  18.347   3.592  17.434
  357    HG   SER  49           HG       SER  49  17.622   3.993  14.859
  358    HA   PRO  50           HA       PRO  50  22.748   0.855  17.340
  359   1HB   PRO  50          HB2       PRO  50  23.338   2.015  19.734
  360   2HB   PRO  50          HB1       PRO  50  23.877   2.654  18.177
  361   1HG   PRO  50          HG2       PRO  50  21.533   3.482  19.852
  362   2HG   PRO  50          HG1       PRO  50  22.731   4.499  19.028
  363   1HD   PRO  50          HD2       PRO  50  20.302   4.077  17.978
  364   2HD   PRO  50          HD1       PRO  50  21.747   4.193  16.951
  365    H    HIS  51           HN       HIS  51  19.703   0.874  18.604
  366    HA   HIS  51           HA       HIS  51  20.419  -1.063  20.692
  367   1HB   HIS  51          HB2       HIS  51  18.098   0.812  20.438
  368   2HB   HIS  51          HB1       HIS  51  17.955  -0.646  21.416
  369    HD1  HIS  51           HD1      HIS  51  18.505  -0.299  23.780
  370    HD2  HIS  51           HD2      HIS  51  20.567   2.348  21.320
  371    HE1  HIS  51           HE1      HIS  51  19.832   1.182  25.329
  372    HE2  HIS  51           HE2      HIS  51  21.248   2.608  23.803
  373    H    LYS  52           HN       LYS  52  18.676  -0.619  17.723
  374    HA   LYS  52           HA       LYS  52  17.367  -1.989  16.437
  375   1HB   LYS  52          HB2       LYS  52  19.073  -4.168  17.655
  376   2HB   LYS  52          HB1       LYS  52  18.226  -4.229  16.120
  377   1HG   LYS  52          HG2       LYS  52  19.680  -2.492  15.229
  378   2HG   LYS  52          HG1       LYS  52  20.520  -2.394  16.779
  379   1HD   LYS  52          HD2       LYS  52  20.375  -4.831  15.002
  380   2HD   LYS  52          HD1       LYS  52  21.765  -3.755  15.162
  381   1HE   LYS  52          HE2       LYS  52  21.973  -4.335  17.512
  382   2HE   LYS  52          HE1       LYS  52  20.537  -5.351  17.408
  383   1HZ   LYS  52          HZ1       LYS  52  22.572  -6.650  17.302
  384   2HZ   LYS  52          HZ2       LYS  52  23.071  -5.798  15.921
  385   3HZ   LYS  52          HZ3       LYS  52  21.696  -6.784  15.857
  386    H    HIS  53           HN       HIS  53  16.061  -1.356  18.763
  387    HA   HIS  53           HA       HIS  53  15.427  -3.605  20.381
  388   1HB   HIS  53          HB2       HIS  53  15.359  -1.152  21.063
  389   2HB   HIS  53          HB1       HIS  53  13.822  -1.056  20.211
  390    HD1  HIS  53           HD1      HIS  53  12.220  -0.804  22.127
  391    HD2  HIS  53           HD2      HIS  53  14.871  -3.955  22.678
  392    HE1  HIS  53           HE1      HIS  53  11.448  -1.979  24.207
  393    HE2  HIS  53           HE2      HIS  53  12.976  -3.969  24.436
  394    H    ALA  54           HN       ALA  54  14.136  -2.370  17.438
  395    HA   ALA  54           HA       ALA  54  11.570  -3.624  17.649
  396   1HB   ALA  54          HB1       ALA  54  13.001  -2.659  15.176
  397   2HB   ALA  54          HB2       ALA  54  11.989  -1.658  16.216
  398   3HB   ALA  54          HB3       ALA  54  11.279  -3.008  15.331
  399    H    THR  55           HN       THR  55  14.615  -4.438  16.005
  400    HA   THR  55           HA       THR  55  13.594  -6.806  14.795
  401    HB   THR  55           HB       THR  55  16.062  -7.283  14.389
  402    HG1  THR  55           HG1      THR  55  17.514  -5.952  15.213
  403   1HG2  THR  55          HG21      THR  55  16.285  -5.495  12.728
  404   2HG2  THR  55          HG22      THR  55  14.970  -4.611  13.501
  405   3HG2  THR  55          HG23      THR  55  14.653  -6.165  12.729
  406    H    ARG  56           HN       ARG  56  15.694  -6.174  17.583
  407    HA   ARG  56           HA       ARG  56  16.145  -8.763  18.464
  408   1HB   ARG  56          HB2       ARG  56  15.810  -6.160  19.933
  409   2HB   ARG  56          HB1       ARG  56  16.142  -7.655  20.794
  410   1HG   ARG  56          HG2       ARG  56  18.252  -7.895  19.750
  411   2HG   ARG  56          HG1       ARG  56  17.895  -6.616  18.586
  412   1HD   ARG  56          HD2       ARG  56  19.410  -6.049  20.583
  413   2HD   ARG  56          HD1       ARG  56  18.103  -4.934  20.187
  414    HE   ARG  56           HE       ARG  56  17.629  -6.982  22.233
  415   1HH1  ARG  56          HH11      ARG  56  18.237  -3.622  21.434
  416   2HH1  ARG  56          HH12      ARG  56  17.586  -3.012  22.932
  417   1HH2  ARG  56          HH21      ARG  56  16.751  -6.177  24.198
  418   2HH2  ARG  56          HH22      ARG  56  16.743  -4.455  24.494
  419    H    HIS  57           HN       HIS  57  13.361  -6.680  18.958
  420    HA   HIS  57           HA       HIS  57  12.032  -8.268  20.856
  421   1HB   HIS  57          HB2       HIS  57  11.408  -5.958  20.549
  422   2HB   HIS  57          HB1       HIS  57  10.973  -6.254  18.869
  423    HD1  HIS  57           HD1      HIS  57   9.792  -7.117  22.378
  424    HD2  HIS  57           HD2      HIS  57   8.439  -7.079  18.443
  425    HE1  HIS  57           HE1      HIS  57   7.317  -7.643  22.463
  426    H    PHE  58           HN       PHE  58  11.848  -8.179  17.312
  427    HA   PHE  58           HA       PHE  58   9.743 -10.006  17.008
  428   1HB   PHE  58          HB2       PHE  58  10.394  -8.754  15.097
  429   2HB   PHE  58          HB1       PHE  58  12.061  -9.307  15.212
  430    HD1  PHE  58           HD1      PHE  58   8.696 -10.937  15.024
  431    HD2  PHE  58           HD2      PHE  58  12.670 -10.732  13.558
  432    HE1  PHE  58           HE1      PHE  58   8.208 -12.774  13.463
  433    HE2  PHE  58           HE2      PHE  58  12.197 -12.561  11.986
  434    HZ   PHE  58           HZ       PHE  58   9.961 -13.590  11.940
  435    H    HIS  59           HN       HIS  59  13.226 -10.494  17.306
  436    HA   HIS  59           HA       HIS  59  13.214 -13.270  16.806
  437   1HB   HIS  59          HB2       HIS  59  15.231 -11.797  16.739
  438   2HB   HIS  59          HB1       HIS  59  15.178 -11.706  18.496
  439    HD1  HIS  59           HD1      HIS  59  15.853 -14.123  15.689
  440    HD2  HIS  59           HD2      HIS  59  16.261 -13.881  19.823
  441    HE1  HIS  59           HE1      HIS  59  17.243 -16.113  16.354
  442    HE2  HIS  59           HE2      HIS  59  17.549 -15.903  18.848
  443    H    ALA  60           HN       ALA  60  12.455 -11.402  19.631
  444    HA   ALA  60           HA       ALA  60  12.723 -13.663  21.428
  445   1HB   ALA  60          HB1       ALA  60  11.708 -10.881  21.985
  446   2HB   ALA  60          HB2       ALA  60  13.381 -11.413  22.153
  447   3HB   ALA  60          HB3       ALA  60  12.128 -12.104  23.184
  448    H    THR  61           HN       THR  61  10.084 -11.694  20.081
  449    HA   THR  61           HA       THR  61   8.154 -13.342  21.545
  450    HB   THR  61           HB       THR  61   6.486 -11.633  20.640
  451    HG1  THR  61           HG1      THR  61   8.923 -10.248  20.077
  452   1HG2  THR  61          HG21      THR  61   8.670 -10.623  22.466
  453   2HG2  THR  61          HG22      THR  61   7.319 -11.642  22.961
  454   3HG2  THR  61          HG23      THR  61   7.018 -10.008  22.368
  455    H    GLY  62           HN       GLY  62   9.210 -12.664  18.283
  456   1HA   GLY  62          HA2       GLY  62   8.693 -13.837  16.343
  457   2HA   GLY  62          HA1       GLY  62   7.499 -14.758  17.250
  458    H    HIS  63           HN       HIS  63   7.712 -11.254  17.081
  459    HA   HIS  63           HA       HIS  63   5.029 -11.218  15.869
  460   1HB   HIS  63          HB2       HIS  63   6.485  -9.118  17.496
  461   2HB   HIS  63          HB1       HIS  63   4.940  -8.845  16.704
  462    HD2  HIS  63           HD2      HIS  63   4.399 -12.205  17.981
  463    HE1  HIS  63           HE1      HIS  63   3.607  -9.686  21.297
  464    HE2  HIS  63           HE2      HIS  63   3.157 -11.965  20.251
  465    HA   PRO  64           HA       PRO  64   7.779 -10.179  12.502
  466   1HB   PRO  64          HB2       PRO  64   6.279 -11.093  10.496
  467   2HB   PRO  64          HB1       PRO  64   7.017 -12.189  11.671
  468   1HG   PRO  64          HG2       PRO  64   4.195 -11.217  11.498
  469   2HG   PRO  64          HG1       PRO  64   4.801 -12.837  11.885
  470   1HD   PRO  64          HD2       PRO  64   3.985 -10.958  13.752
  471   2HD   PRO  64          HD1       PRO  64   5.055 -12.331  14.092
  472    H    ILE  65           HN       ILE  65   5.154  -8.352  13.334
  473    HA   ILE  65           HA       ILE  65   5.496  -6.688  10.934
  474    HB   ILE  65           HB       ILE  65   2.860  -7.212  12.311
  475   1HG1  ILE  65          HG12      ILE  65   3.849  -7.824   9.511
  476   2HG1  ILE  65          HG11      ILE  65   3.544  -9.003  10.782
  477   1HG2  ILE  65          HG21      ILE  65   3.021  -4.872  11.687
  478   2HG2  ILE  65          HG22      ILE  65   1.907  -5.704  10.602
  479   3HG2  ILE  65          HG23      ILE  65   3.540  -5.314  10.061
  480   1HD1  ILE  65          HD11      ILE  65   1.752  -8.974   9.150
  481   2HD1  ILE  65          HD12      ILE  65   1.485  -7.258   9.454
  482   3HD1  ILE  65          HD13      ILE  65   1.171  -8.438  10.727
  483    H    ILE  66           HN       ILE  66   6.165  -4.750  11.335
  484    HA   ILE  66           HA       ILE  66   5.385  -3.436  13.851
  485    HB   ILE  66           HB       ILE  66   7.539  -2.195  13.785
  486   1HG1  ILE  66          HG12      ILE  66   8.366  -4.264  11.738
  487   2HG1  ILE  66          HG11      ILE  66   7.975  -2.592  11.350
  488   1HG2  ILE  66          HG21      ILE  66   7.252  -4.105  15.263
  489   2HG2  ILE  66          HG22      ILE  66   8.911  -4.010  14.675
  490   3HG2  ILE  66          HG23      ILE  66   7.798  -5.191  13.984
  491   1HD1  ILE  66          HD11      ILE  66   9.816  -1.849  12.784
  492   2HD1  ILE  66          HD12      ILE  66  10.363  -2.893  11.470
  493   3HD1  ILE  66          HD13      ILE  66  10.224  -3.534  13.108
  494    H    GLU  67           HN       GLU  67   4.760  -1.317  13.683
  495    HA   GLU  67           HA       GLU  67   4.338  -0.344  10.944
  496   1HB   GLU  67          HB2       GLU  67   2.334  -0.645  12.321
  497   2HB   GLU  67          HB1       GLU  67   3.004   0.417  13.549
  498   1HG   GLU  67          HG2       GLU  67   2.939   2.279  11.963
  499   2HG   GLU  67          HG1       GLU  67   2.240   1.207  10.748
  500    H    GLY  68           HN       GLY  68   5.000   1.706  10.330
  501   1HA   GLY  68          HA2       GLY  68   7.236   2.827  11.683
  502   2HA   GLY  68          HA1       GLY  68   6.378   3.551  10.329
  503    H    TYR  69           HN       TYR  69   6.986   3.711  13.660
  504    HA   TYR  69           HA       TYR  69   4.553   5.214  14.230
  505   1HB   TYR  69          HB2       TYR  69   5.383   3.444  15.804
  506   2HB   TYR  69          HB1       TYR  69   6.775   4.468  16.139
  507    HD1  TYR  69           HD1      TYR  69   6.489   5.040  18.394
  508    HD2  TYR  69           HD2      TYR  69   3.221   5.482  15.706
  509    HE1  TYR  69           HE1      TYR  69   5.211   6.201  20.146
  510    HE2  TYR  69           HE2      TYR  69   1.935   6.642  17.449
  511    HH   TYR  69           HH       TYR  69   3.387   7.575  20.494
  512    H    ASP  70           HN       ASP  70   8.009   5.696  13.857
  513    HA   ASP  70           HA       ASP  70   7.875   8.412  14.788
  514   1HB   ASP  70          HB2       ASP  70  10.195   8.586  14.410
  515   2HB   ASP  70          HB1       ASP  70   9.939   6.938  14.954
  516    HA   PRO  71           HA       PRO  71   7.476   9.535  10.268
  517   1HB   PRO  71          HB2       PRO  71   7.338   7.587   8.353
  518   2HB   PRO  71          HB1       PRO  71   8.850   8.298   8.921
  519   1HG   PRO  71          HG2       PRO  71   7.888   5.607   9.286
  520   2HG   PRO  71          HG1       PRO  71   9.441   6.296   9.780
  521   1HD   PRO  71          HD2       PRO  71   6.987   5.863  11.364
  522   2HD   PRO  71          HD1       PRO  71   8.670   6.032  11.908
  523    HA   PRO  72           HA       PRO  72   3.016   8.640  10.693
  524   1HB   PRO  72          HB2       PRO  72   2.758  11.419   9.784
  525   2HB   PRO  72          HB1       PRO  72   2.205  10.676  11.287
  526   1HG   PRO  72          HG2       PRO  72   4.250  12.415  11.245
  527   2HG   PRO  72          HG1       PRO  72   4.214  11.038  12.364
  528   1HD   PRO  72          HD2       PRO  72   5.692  11.329   9.767
  529   2HD   PRO  72          HD1       PRO  72   6.261  10.672  11.319
  530    H    GLU  73           HN       GLU  73   4.615   8.073   8.273
  531    HA   GLU  73           HA       GLU  73   3.131   9.093   6.025
  532   1HB   GLU  73          HB2       GLU  73   5.038   6.747   6.140
  533   2HB   GLU  73          HB1       GLU  73   4.527   7.617   4.700
  534   1HG   GLU  73          HG2       GLU  73   5.707   9.582   5.394
  535   2HG   GLU  73          HG1       GLU  73   6.088   8.854   6.953
  536    H    GLY  74           HN       GLY  74   3.055   6.340   8.131
  537   1HA   GLY  74          HA2       GLY  74   1.270   4.892   8.486
  538   2HA   GLY  74          HA1       GLY  74   0.491   5.540   7.049
  539    H    TRP  75           HN       TRP  75   3.152   3.448   8.107
  540    HA   TRP  75           HA       TRP  75   2.393   1.555   6.068
  541   1HB   TRP  75          HB2       TRP  75   4.742   1.323   5.213
  542   2HB   TRP  75          HB1       TRP  75   3.933   2.812   4.747
  543    HD1  TRP  75           HD1      TRP  75   5.040   5.059   5.453
  544    HE1  TRP  75           HE1      TRP  75   7.257   5.678   6.613
  545    HE3  TRP  75           HE3      TRP  75   6.379   0.420   7.140
  546    HZ2  TRP  75           HZ2      TRP  75   9.288   4.360   8.063
  547    HZ3  TRP  75           HZ3      TRP  75   8.475   0.188   8.407
  548    HH2  TRP  75           HH2      TRP  75   9.896   2.118   8.857
  549    H    GLY  76           HN       GLY  76   3.464  -0.513   6.309
  550   1HA   GLY  76          HA2       GLY  76   4.559  -0.919   9.016
  551   2HA   GLY  76          HA1       GLY  76   3.253  -1.928   8.412
  552    H    TRP  77           HN       TRP  77   6.020  -2.560   9.257
  553    HA   TRP  77           HA       TRP  77   7.068  -3.655   6.731
  554   1HB   TRP  77          HB2       TRP  77   8.650  -2.172   7.846
  555   2HB   TRP  77          HB1       TRP  77   8.480  -3.073   9.347
  556    HD1  TRP  77           HD1      TRP  77   9.960  -5.218   9.647
  557    HE1  TRP  77           HE1      TRP  77  11.810  -6.322   8.234
  558    HE3  TRP  77           HE3      TRP  77   9.358  -2.576   5.312
  559    HZ2  TRP  77           HZ2      TRP  77  12.873  -6.096   5.633
  560    HZ3  TRP  77           HZ3      TRP  77  10.835  -3.080   3.409
  561    HH2  TRP  77           HH2      TRP  77  12.556  -4.804   3.568
  562    H    CYS  78           HN       CYS  78   7.148  -5.797   6.479
  563    HA   CYS  78           HA       CYS  78   6.494  -7.468   8.819
  564   1HB   CYS  78          HB2       CYS  78   4.963  -7.364   6.697
  565   2HB   CYS  78          HB1       CYS  78   6.188  -8.392   5.982
  566    H    TYR  79           HN       TYR  79   8.257  -8.411   9.600
  567    HA   TYR  79           HA       TYR  79  10.770  -8.316   8.465
  568   1HB   TYR  79          HB2       TYR  79   9.664 -10.181  10.559
  569   2HB   TYR  79          HB1       TYR  79  11.371 -10.115  10.135
  570    HD1  TYR  79           HD1      TYR  79  12.524  -7.810  10.335
  571    HD2  TYR  79           HD2      TYR  79   8.823  -8.760  12.206
  572    HE1  TYR  79           HE1      TYR  79  12.868  -5.978  11.936
  573    HE2  TYR  79           HE2      TYR  79   9.155  -6.927  13.806
  574    HH   TYR  79           HH       TYR  79  11.111  -5.661  14.761
  575    H    VAL  80           HN       VAL  80   8.762 -11.262   8.696
  576    HA   VAL  80           HA       VAL  80  10.609 -12.840   7.255
  577    HB   VAL  80           HB       VAL  80   8.769 -14.531   7.141
  578   1HG1  VAL  80          HG11      VAL  80  10.312 -14.474   9.019
  579   2HG1  VAL  80          HG12      VAL  80   8.695 -14.918   9.565
  580   3HG1  VAL  80          HG13      VAL  80   9.300 -13.284   9.837
  581   1HG2  VAL  80          HG21      VAL  80   6.849 -13.070   7.000
  582   2HG2  VAL  80          HG22      VAL  80   7.216 -12.382   8.582
  583   3HG2  VAL  80          HG23      VAL  80   6.719 -14.069   8.448
  584    H    ASP  81           HN       ASP  81   8.167 -10.686   6.188
  585    HA   ASP  81           HA       ASP  81   7.921 -11.931   3.562
  586   1HB   ASP  81          HB2       ASP  81   6.722  -9.348   4.580
  587   2HB   ASP  81          HB1       ASP  81   6.332 -10.136   3.061
  588    H    GLU  82           HN       GLU  82   9.432  -9.233   5.151
  589    HA   GLU  82           HA       GLU  82  11.072  -7.792   4.547
  590   1HB   GLU  82          HB2       GLU  82  11.280  -9.526   2.081
  591   2HB   GLU  82          HB1       GLU  82  12.416  -8.255   2.514
  592   1HG   GLU  82          HG2       GLU  82  13.073  -9.434   4.493
  593   2HG   GLU  82          HG1       GLU  82  11.820 -10.647   4.235
  594    H    VAL  83           HN       VAL  83   8.200  -7.597   3.671
  595    HA   VAL  83           HA       VAL  83   8.570  -5.596   1.550
  596    HB   VAL  83           HB       VAL  83   6.217  -5.877   0.958
  597   1HG1  VAL  83          HG11      VAL  83   7.727  -8.485   1.027
  598   2HG1  VAL  83          HG12      VAL  83   7.862  -7.229  -0.204
  599   3HG1  VAL  83          HG13      VAL  83   6.352  -8.123  -0.016
  600   1HG2  VAL  83          HG21      VAL  83   4.882  -7.706   1.902
  601   2HG2  VAL  83          HG22      VAL  83   5.322  -6.516   3.129
  602   3HG2  VAL  83          HG23      VAL  83   6.178  -8.056   3.045
  603    H    MET  84           HN       MET  84   7.669  -3.596   1.760
  604    HA   MET  84           HA       MET  84   6.627  -2.906   4.430
  605   1HB   MET  84          HB2       MET  84   8.726  -1.778   3.845
  606   2HB   MET  84          HB1       MET  84   8.004  -1.177   2.361
  607   1HG   MET  84          HG2       MET  84   6.465   0.192   3.619
  608   2HG   MET  84          HG1       MET  84   7.075  -0.470   5.135
  609   1HE   MET  84          HE1       MET  84   9.318   0.369   2.023
  610   2HE   MET  84          HE2       MET  84   9.699   2.068   2.302
  611   3HE   MET  84          HE3       MET  84   8.047   1.588   1.914
  612    H    PHE  85           HN       PHE  85   4.484  -2.801   4.394
  613    HA   PHE  85           HA       PHE  85   3.144  -2.013   1.892
  614   1HB   PHE  85          HB2       PHE  85   1.123  -3.104   2.965
  615   2HB   PHE  85          HB1       PHE  85   2.444  -4.190   2.554
  616    HD1  PHE  85           HD1      PHE  85   0.763  -2.446   5.342
  617    HD2  PHE  85           HD2      PHE  85   3.553  -5.454   4.211
  618    HE1  PHE  85           HE1      PHE  85   0.791  -3.287   7.652
  619    HE2  PHE  85           HE2      PHE  85   3.582  -6.295   6.520
  620    HZ   PHE  85           HZ       PHE  85   2.203  -5.214   8.244
  621    H    ASP  86           HN       ASP  86   0.965  -0.935   2.267
  622    HA   ASP  86           HA       ASP  86   1.542   1.451   3.808
  623   1HB   ASP  86          HB2       ASP  86  -0.755   0.849   1.937
  624   2HB   ASP  86          HB1       ASP  86  -0.382   2.422   2.636
  625    H    LEU  87           HN       LEU  87   0.604   2.043   5.626
  626    HA   LEU  87           HA       LEU  87  -1.830   0.638   6.502
  627   1HB   LEU  87          HB2       LEU  87   0.631   1.324   8.092
  628   2HB   LEU  87          HB1       LEU  87  -0.917   1.048   8.867
  629    HG   LEU  87           HG       LEU  87   0.597  -0.959   7.192
  630   1HD1  LEU  87          HD11      LEU  87   0.088  -0.838  10.161
  631   2HD1  LEU  87          HD12      LEU  87   1.633  -0.538   9.364
  632   3HD1  LEU  87          HD13      LEU  87   0.904  -2.144   9.301
  633   1HD2  LEU  87          HD21      LEU  87  -1.819  -1.233   6.983
  634   2HD2  LEU  87          HD22      LEU  87  -1.979  -1.234   8.739
  635   3HD2  LEU  87          HD23      LEU  87  -1.114  -2.542   7.932
  636    H    SER  88           HN       SER  88  -1.428   3.177   5.089
  637    HA   SER  88           HA       SER  88  -1.572   5.356   6.875
  638   1HB   SER  88          HB2       SER  88  -2.602   5.228   4.034
  639   2HB   SER  88          HB1       SER  88  -2.158   6.679   4.934
  640    HG   SER  88           HG       SER  88  -0.016   5.998   4.924
  641    H    ASP  89           HN       ASP  89  -3.902   3.013   6.028
  642    HA   ASP  89           HA       ASP  89  -6.105   4.794   6.813
  643   1HB   ASP  89          HB2       ASP  89  -6.147   2.080   5.485
  644   2HB   ASP  89          HB1       ASP  89  -7.588   2.958   5.986
  645    H    ARG  90           HN       ARG  90  -4.016   2.635   8.210
  646    HA   ARG  90           HA       ARG  90  -5.990   1.938  10.283
  647   1HB   ARG  90          HB2       ARG  90  -3.862   0.063   9.239
  648   2HB   ARG  90          HB1       ARG  90  -5.027  -0.286  10.507
  649   1HG   ARG  90          HG2       ARG  90  -6.839   0.001   8.820
  650   2HG   ARG  90          HG1       ARG  90  -5.586   0.138   7.582
  651   1HD   ARG  90          HD2       ARG  90  -4.730  -2.082   8.277
  652   2HD   ARG  90          HD1       ARG  90  -6.082  -2.216   9.400
  653    HE   ARG  90           HE       ARG  90  -6.337  -2.107   6.457
  654   1HH1  ARG  90          HH11      ARG  90  -7.593  -2.992   9.606
  655   2HH1  ARG  90          HH12      ARG  90  -8.832  -4.026   8.966
  656   1HH2  ARG  90          HH21      ARG  90  -7.958  -3.461   5.616
  657   2HH2  ARG  90          HH22      ARG  90  -9.049  -4.283   6.688
  658    H    MET  91           HN       MET  91  -3.461   3.761   9.790
  659    HA   MET  91           HA       MET  91  -1.390   2.828  11.418
  660   1HB   MET  91          HB2       MET  91  -0.540   5.137  11.388
  661   2HB   MET  91          HB1       MET  91  -1.007   4.571   9.793
  662   1HG   MET  91          HG2       MET  91  -3.099   5.820   9.962
  663   2HG   MET  91          HG1       MET  91  -2.624   6.392  11.560
  664   1HE   MET  91          HE1       MET  91   0.524   6.880  11.132
  665   2HE   MET  91          HE2       MET  91  -0.554   7.965  12.009
  666   3HE   MET  91          HE3       MET  91   0.500   8.602  10.747
  667    H    THR  92           HN       THR  92  -0.713   3.293  13.463
  668    HA   THR  92           HA       THR  92  -2.789   3.364  15.412
  669    HB   THR  92           HB       THR  92   0.166   3.656  15.957
  670    HG1  THR  92           HG1      THR  92   0.018   1.899  14.598
  671   1HG2  THR  92          HG21      THR  92  -1.319   3.880  17.886
  672   2HG2  THR  92          HG22      THR  92  -0.382   2.389  17.983
  673   3HG2  THR  92          HG23      THR  92  -2.075   2.336  17.492
  674    HA   PRO  93           HA       PRO  93  -2.883   7.801  16.108
  675   1HB   PRO  93          HB2       PRO  93  -4.152   7.076  18.664
  676   2HB   PRO  93          HB1       PRO  93  -4.791   8.042  17.331
  677   1HG   PRO  93          HG2       PRO  93  -5.712   5.573  17.859
  678   2HG   PRO  93          HG1       PRO  93  -5.594   6.197  16.203
  679   1HD   PRO  93          HD2       PRO  93  -3.779   4.305  17.650
  680   2HD   PRO  93          HD1       PRO  93  -4.343   4.261  15.965
  681    H    HIS  94           HN       HIS  94  -1.056   8.772  16.726
  682    HA   HIS  94           HA       HIS  94   0.757   7.712  18.593
  683   1HB   HIS  94          HB2       HIS  94   2.046   9.701  18.319
  684   2HB   HIS  94          HB1       HIS  94   1.322   9.345  16.759
  685    HD1  HIS  94           HD1      HIS  94   2.035  12.101  18.821
  686    HD2  HIS  94           HD2      HIS  94  -1.268  11.006  16.545
  687    HE1  HIS  94           HE1      HIS  94   0.766  14.229  18.402
  688    HE2  HIS  94           HE2      HIS  94  -1.156  13.567  16.915
  689    H    ASN  95           HN       ASN  95   1.237   8.201  20.705
  690    HA   ASN  95           HA       ASN  95  -1.056   9.161  22.225
  691   1HB   ASN  95          HB2       ASN  95  -0.022   8.127  24.141
  692   2HB   ASN  95          HB1       ASN  95   0.050   7.001  22.792
  693   1HD2  ASN  95          HD21      ASN  95   1.659   7.097  25.191
  694   2HD2  ASN  95          HD22      ASN  95   3.299   7.253  24.673
  695    H    GLY  96           HN       GLY  96   1.607  10.583  20.946
  696   1HA   GLY  96          HA2       GLY  96   1.241  13.025  22.205
  697   2HA   GLY  96          HA1       GLY  96   2.514  12.198  23.092
  698    HA   PRO  97           HA       PRO  97   4.389  14.288  19.342
  699   1HB   PRO  97          HB2       PRO  97   5.727  16.140  21.115
  700   2HB   PRO  97          HB1       PRO  97   4.579  16.493  19.822
  701   1HG   PRO  97          HG2       PRO  97   4.036  16.860  22.478
  702   2HG   PRO  97          HG1       PRO  97   2.795  16.548  21.251
  703   1HD   PRO  97          HD2       PRO  97   4.047  14.657  23.206
  704   2HD   PRO  97          HD1       PRO  97   2.352  14.785  22.688
  705    H    ILE  98           HN       ILE  98   5.996  12.967  18.781
  706    HA   ILE  98           HA       ILE  98   7.841  11.923  20.744
  707    HB   ILE  98           HB       ILE  98   7.744  11.476  17.755
  708   1HG1  ILE  98          HG12      ILE  98   6.653   9.814  20.040
  709   2HG1  ILE  98          HG11      ILE  98   5.697  10.719  18.871
  710   1HG2  ILE  98          HG21      ILE  98   9.942  11.004  18.675
  711   2HG2  ILE  98          HG22      ILE  98   9.131   9.504  18.223
  712   3HG2  ILE  98          HG23      ILE  98   9.222   9.981  19.918
  713   1HD1  ILE  98          HD11      ILE  98   6.575   9.276  17.082
  714   2HD1  ILE  98          HD12      ILE  98   5.693   8.378  18.318
  715   3HD1  ILE  98          HD13      ILE  98   7.456   8.348  18.298
  716    HA   PRO  99           HA       PRO  99  10.939  15.104  20.110
  717   1HB   PRO  99          HB2       PRO  99  12.718  12.997  21.203
  718   2HB   PRO  99          HB1       PRO  99  12.471  14.658  21.753
  719   1HG   PRO  99          HG2       PRO  99  11.473  12.593  23.120
  720   2HG   PRO  99          HG1       PRO  99  10.575  14.115  22.966
  721   1HD   PRO  99          HD2       PRO  99  10.172  11.521  21.534
  722   2HD   PRO  99          HD1       PRO  99   8.965  12.671  22.146
  723    H    ARG 100           HN       ARG 100  11.579  15.395  18.074
  724    HA   ARG 100           HA       ARG 100  12.549  13.123  16.520
  725   1HB   ARG 100          HB2       ARG 100  10.831  14.729  15.616
  726   2HB   ARG 100          HB1       ARG 100  12.084  15.962  15.597
  727   1HG   ARG 100          HG2       ARG 100  11.860  15.050  13.397
  728   2HG   ARG 100          HG1       ARG 100  13.407  14.529  14.071
  729   1HD   ARG 100          HD2       ARG 100  12.390  12.377  14.687
  730   2HD   ARG 100          HD1       ARG 100  10.871  12.899  13.962
  731    HE   ARG 100           HE       ARG 100  13.282  12.812  12.289
  732   1HH1  ARG 100          HH11      ARG 100  10.085  11.590  13.080
  733   2HH1  ARG 100          HH12      ARG 100   9.991  10.572  11.679
  734   1HH2  ARG 100          HH21      ARG 100  13.129  11.498  10.425
  735   2HH2  ARG 100          HH22      ARG 100  11.702  10.544  10.157
  736    H    TYR 101           HN       TYR 101  14.638  12.693  16.879
  737    HA   TYR 101           HA       TYR 101  16.556  14.813  17.300
  738   1HB   TYR 101          HB2       TYR 101  16.960  11.825  17.027
  739   2HB   TYR 101          HB1       TYR 101  18.206  12.979  17.485
  740    HD1  TYR 101           HD1      TYR 101  17.602  14.470  19.582
  741    HD2  TYR 101           HD2      TYR 101  15.821  10.711  18.698
  742    HE1  TYR 101           HE1      TYR 101  16.974  14.219  21.945
  743    HE2  TYR 101           HE2      TYR 101  15.187  10.450  21.058
  744    HH   TYR 101           HH       TYR 101  15.236  12.980  23.267
  745    H    VAL 102           HN       VAL 102  15.462  12.773  14.718
  746    HA   VAL 102           HA       VAL 102  17.567  13.834  12.969
  747    HB   VAL 102           HB       VAL 102  16.878  11.921  11.421
  748   1HG1  VAL 102          HG11      VAL 102  18.113  11.258  14.094
  749   2HG1  VAL 102          HG12      VAL 102  18.958  11.922  12.695
  750   3HG1  VAL 102          HG13      VAL 102  18.269  10.300  12.621
  751   1HG2  VAL 102          HG21      VAL 102  14.753  11.361  12.481
  752   2HG2  VAL 102          HG22      VAL 102  15.596  10.928  13.968
  753   3HG2  VAL 102          HG23      VAL 102  15.844   9.975  12.505
  Start of MODEL   19
    1   1H    MET   1          HT1       MET   1   6.230  -0.428  -2.445
    2   2H    MET   1          HT2       MET   1   6.342   1.050  -1.617
    3   3H    MET   1          HT3       MET   1   5.129   0.819  -2.775
    4    HA   MET   1           HA       MET   1   5.384  -0.638  -0.214
    5   1HB   MET   1          HB2       MET   1   3.498   0.603   0.561
    6   2HB   MET   1          HB1       MET   1   4.648   1.770  -0.070
    7   1HG   MET   1          HG2       MET   1   2.193   0.768  -1.497
    8   2HG   MET   1          HG1       MET   1   2.355   2.323  -0.685
    9   1HE   MET   1          HE1       MET   1   1.519   3.545  -2.901
   10   2HE   MET   1          HE2       MET   1   1.368   1.985  -3.710
   11   3HE   MET   1          HE3       MET   1   2.251   3.300  -4.486
   12    H    THR   2           HN       THR   2   3.554  -1.997   0.252
   13    HA   THR   2           HA       THR   2   2.291  -3.069  -2.185
   14    HB   THR   2           HB       THR   2   2.104  -5.217  -0.838
   15    HG1  THR   2           HG1      THR   2   3.954  -3.800   0.812
   16   1HG2  THR   2          HG21      THR   2   4.419  -5.896  -1.280
   17   2HG2  THR   2          HG22      THR   2   4.880  -4.204  -1.467
   18   3HG2  THR   2          HG23      THR   2   3.764  -4.945  -2.614
   19    H    MET   3           HN       MET   3   0.317  -4.588  -1.252
   20    HA   MET   3           HA       MET   3  -1.528  -2.661  -0.107
   21   1HB   MET   3          HB2       MET   3  -2.201  -4.092  -2.007
   22   2HB   MET   3          HB1       MET   3  -1.979  -5.517  -1.003
   23   1HG   MET   3          HG2       MET   3  -4.308  -5.018  -1.119
   24   2HG   MET   3          HG1       MET   3  -3.741  -4.669   0.512
   25   1HE   MET   3          HE1       MET   3  -4.902  -3.165  -2.920
   26   2HE   MET   3          HE2       MET   3  -3.257  -2.546  -2.768
   27   3HE   MET   3          HE3       MET   3  -4.628  -1.441  -2.667
   28    H    GLY   4           HN       GLY   4  -0.005  -5.710   0.756
   29   1HA   GLY   4          HA2       GLY   4   0.344  -5.510   3.369
   30   2HA   GLY   4          HA1       GLY   4  -1.393  -5.782   3.319
   31    H    CYS   5           HN       CYS   5  -1.299  -7.764   4.351
   32    HA   CYS   5           HA       CYS   5  -0.876 -10.012   2.663
   33   1HB   CYS   5          HB2       CYS   5   0.886 -11.124   3.915
   34   2HB   CYS   5          HB1       CYS   5   1.475  -9.563   3.354
   35    H    ARG   6           HN       ARG   6  -1.157 -12.106   4.094
   36    HA   ARG   6           HA       ARG   6  -3.689 -11.962   5.233
   37   1HB   ARG   6          HB2       ARG   6  -3.304 -14.263   6.005
   38   2HB   ARG   6          HB1       ARG   6  -2.769 -14.031   4.347
   39   1HG   ARG   6          HG2       ARG   6  -0.443 -13.766   5.216
   40   2HG   ARG   6          HG1       ARG   6  -1.051 -14.222   6.809
   41   1HD   ARG   6          HD2       ARG   6  -1.845 -16.352   5.876
   42   2HD   ARG   6          HD1       ARG   6  -1.194 -15.895   4.303
   43    HE   ARG   6           HE       ARG   6   0.450 -16.374   6.709
   44   1HH1  ARG   6          HH11      ARG   6   0.007 -16.415   3.233
   45   2HH1  ARG   6          HH12      ARG   6   1.547 -17.173   2.926
   46   1HH2  ARG   6          HH21      ARG   6   2.459 -17.374   6.303
   47   2HH2  ARG   6          HH22      ARG   6   2.925 -17.727   4.662
   48    H    HIS   7           HN       HIS   7  -0.575 -11.565   6.740
   49    HA   HIS   7           HA       HIS   7  -1.339 -11.895   9.429
   50   1HB   HIS   7          HB2       HIS   7   0.880 -10.237   8.223
   51   2HB   HIS   7          HB1       HIS   7   0.695 -10.535   9.947
   52    HD2  HIS   7           HD2      HIS   7   0.619 -13.503  10.432
   53    HE1  HIS   7           HE1      HIS   7   3.507 -13.996   7.383
   54    HE2  HIS   7           HE2      HIS   7   2.541 -14.985   9.512
   55    H    VAL   8           HN       VAL   8  -1.889  -9.326   7.197
   56    HA   VAL   8           HA       VAL   8  -2.037  -7.154   8.984
   57    HB   VAL   8           HB       VAL   8  -2.191  -7.410   6.259
   58   1HG1  VAL   8          HG11      VAL   8  -4.890  -6.442   7.169
   59   2HG1  VAL   8          HG12      VAL   8  -4.574  -7.964   6.335
   60   3HG1  VAL   8          HG13      VAL   8  -4.279  -6.430   5.515
   61   1HG2  VAL   8          HG21      VAL   8  -1.297  -5.514   7.478
   62   2HG2  VAL   8          HG22      VAL   8  -2.929  -5.009   7.915
   63   3HG2  VAL   8          HG23      VAL   8  -2.420  -4.979   6.227
   64    H    ALA   9           HN       ALA   9  -4.274  -9.707   8.210
   65    HA   ALA   9           HA       ALA   9  -6.616  -8.434   9.228
   66   1HB   ALA   9          HB1       ALA   9  -6.035 -11.364   8.815
   67   2HB   ALA   9          HB2       ALA   9  -6.751 -10.269   7.633
   68   3HB   ALA   9          HB3       ALA   9  -7.623 -10.659   9.115
   69    H    GLY  10           HN       GLY  10  -3.904  -9.279  10.850
   70   1HA   GLY  10          HA2       GLY  10  -5.418 -10.012  13.279
   71   2HA   GLY  10          HA1       GLY  10  -3.793 -10.585  12.945
   72    H    ILE  11           HN       ILE  11  -4.082  -7.378  11.966
   73    HA   ILE  11           HA       ILE  11  -2.791  -6.511  14.458
   74    HB   ILE  11           HB       ILE  11  -1.991  -4.546  13.206
   75   1HG1  ILE  11          HG12      ILE  11  -3.193  -5.944  10.804
   76   2HG1  ILE  11          HG11      ILE  11  -3.784  -4.448  11.518
   77   1HG2  ILE  11          HG21      ILE  11  -0.574  -6.491  13.427
   78   2HG2  ILE  11          HG22      ILE  11  -0.335  -5.750  11.845
   79   3HG2  ILE  11          HG23      ILE  11  -1.302  -7.217  11.994
   80   1HD1  ILE  11          HD11      ILE  11  -1.073  -4.818  10.270
   81   2HD1  ILE  11          HD12      ILE  11  -1.745  -3.312  10.898
   82   3HD1  ILE  11          HD13      ILE  11  -2.471  -4.083   9.486
   83    H    ARG  12           HN       ARG  12  -3.439  -4.679  15.552
   84    HA   ARG  12           HA       ARG  12  -5.985  -3.471  14.716
   85   1HB   ARG  12          HB2       ARG  12  -6.786  -3.540  17.031
   86   2HB   ARG  12          HB1       ARG  12  -6.475  -5.161  16.428
   87   1HG   ARG  12          HG2       ARG  12  -4.253  -5.065  17.583
   88   2HG   ARG  12          HG1       ARG  12  -4.783  -3.555  18.326
   89   1HD   ARG  12          HD2       ARG  12  -6.155  -6.227  18.580
   90   2HD   ARG  12          HD1       ARG  12  -5.135  -5.475  19.804
   91    HE   ARG  12           HE       ARG  12  -6.928  -3.594  19.616
   92   1HH1  ARG  12          HH11      ARG  12  -7.520  -7.027  19.309
   93   2HH1  ARG  12          HH12      ARG  12  -9.089  -6.953  20.050
   94   1HH2  ARG  12          HH21      ARG  12  -9.001  -3.490  20.602
   95   2HH2  ARG  12          HH22      ARG  12  -9.924  -4.952  20.794
   96    H    THR  13           HN       THR  13  -6.413  -1.438  16.127
   97    HA   THR  13           HA       THR  13  -4.022   0.185  16.071
   98    HB   THR  13           HB       THR  13  -6.782   0.952  17.053
   99    HG1  THR  13           HG1      THR  13  -6.829   1.893  14.830
  100   1HG2  THR  13          HG21      THR  13  -5.005   2.494  17.737
  101   2HG2  THR  13          HG22      THR  13  -6.047   3.236  16.524
  102   3HG2  THR  13          HG23      THR  13  -4.460   2.619  16.064
  103    H    VAL  14           HN       VAL  14  -2.627  -0.224  17.653
  104    HA   VAL  14           HA       VAL  14  -3.592  -1.081  20.257
  105    HB   VAL  14           HB       VAL  14  -1.123  -1.526  20.665
  106   1HG1  VAL  14          HG11      VAL  14  -1.142  -3.570  19.288
  107   2HG1  VAL  14          HG12      VAL  14  -2.518  -2.932  18.388
  108   3HG1  VAL  14          HG13      VAL  14  -2.681  -3.299  20.105
  109   1HG2  VAL  14          HG21      VAL  14  -0.989  -1.002  17.693
  110   2HG2  VAL  14          HG22      VAL  14   0.307  -1.668  18.687
  111   3HG2  VAL  14          HG23      VAL  14  -0.244  -0.013  18.950
  112    H    THR  15           HN       THR  15  -2.691  -0.267  22.213
  113    HA   THR  15           HA       THR  15  -2.487   2.611  22.228
  114    HB   THR  15           HB       THR  15  -2.224   0.752  24.595
  115    HG1  THR  15           HG1      THR  15  -4.410   1.282  22.988
  116   1HG2  THR  15          HG21      THR  15  -3.245   3.585  24.340
  117   2HG2  THR  15          HG22      THR  15  -1.675   3.110  24.988
  118   3HG2  THR  15          HG23      THR  15  -3.153   2.649  25.833
  119    HA   PRO  16           HA       PRO  16   1.994   2.521  22.021
  120   1HB   PRO  16          HB2       PRO  16   1.715   5.305  22.985
  121   2HB   PRO  16          HB1       PRO  16   2.507   4.693  21.529
  122   1HG   PRO  16          HG2       PRO  16   0.176   5.996  21.395
  123   2HG   PRO  16          HG1       PRO  16   0.535   4.630  20.321
  124   1HD   PRO  16          HD2       PRO  16  -1.174   4.717  22.776
  125   2HD   PRO  16          HD1       PRO  16  -1.446   3.865  21.241
  126    H    SER  17           HN       SER  17   3.094   1.551  23.592
  127    HA   SER  17           HA       SER  17   2.530   1.964  26.365
  128   1HB   SER  17          HB2       SER  17   3.252  -0.225  25.480
  129   2HB   SER  17          HB1       SER  17   4.817   0.469  25.058
  130    HG   SER  17           HG       SER  17   3.770   0.476  27.699
  131    H    ALA  18           HN       ALA  18   4.828   3.237  24.090
  132    HA   ALA  18           HA       ALA  18   5.799   5.078  26.136
  133   1HB   ALA  18          HB1       ALA  18   7.450   3.256  26.074
  134   2HB   ALA  18          HB2       ALA  18   8.129   4.769  25.472
  135   3HB   ALA  18          HB3       ALA  18   7.650   3.506  24.339
  136    H    LEU  19           HN       LEU  19   6.918   6.960  25.156
  137    HA   LEU  19           HA       LEU  19   5.533   7.891  22.827
  138   1HB   LEU  19          HB2       LEU  19   7.928   9.076  24.243
  139   2HB   LEU  19          HB1       LEU  19   6.918   9.902  23.071
  140    HG   LEU  19           HG       LEU  19   6.015   8.944  25.790
  141   1HD1  LEU  19          HD11      LEU  19   6.588  11.721  24.766
  142   2HD1  LEU  19          HD12      LEU  19   7.559  10.821  25.932
  143   3HD1  LEU  19          HD13      LEU  19   5.919  11.320  26.348
  144   1HD2  LEU  19          HD21      LEU  19   3.977  10.206  25.311
  145   2HD2  LEU  19          HD22      LEU  19   4.215   8.904  24.144
  146   3HD2  LEU  19          HD23      LEU  19   4.580  10.570  23.694
  147    H    GLY  20           HN       GLY  20   8.720   6.670  23.546
  148   1HA   GLY  20          HA2       GLY  20   9.144   6.133  20.719
  149   2HA   GLY  20          HA1       GLY  20  10.351   7.124  21.531
  150    H    CYS  21           HN       CYS  21  12.101   5.887  21.872
  151    HA   CYS  21           HA       CYS  21  11.747   3.103  22.619
  152   1HB   CYS  21          HB2       CYS  21  13.562   3.900  21.015
  153   2HB   CYS  21          HB1       CYS  21  14.372   4.581  22.424
  154    HG   CYS  21           HG       CYS  21  13.497   1.378  22.804
  155    H    GLU  22           HN       GLU  22  11.202   2.760  24.628
  156    HA   GLU  22           HA       GLU  22  11.370   4.654  26.672
  157   1HB   GLU  22          HB2       GLU  22  10.404   2.996  28.091
  158   2HB   GLU  22          HB1       GLU  22   9.700   2.807  26.494
  159   1HG   GLU  22          HG2       GLU  22  11.863   1.081  27.689
  160   2HG   GLU  22          HG1       GLU  22  10.158   0.665  27.550
  161    H    GLU  23           HN       GLU  23  13.437   1.887  25.938
  162    HA   GLU  23           HA       GLU  23  14.977   2.016  28.308
  163   1HB   GLU  23          HB2       GLU  23  14.893   0.024  26.884
  164   2HB   GLU  23          HB1       GLU  23  15.713   0.899  25.599
  165   1HG   GLU  23          HG2       GLU  23  17.697   1.108  26.965
  166   2HG   GLU  23          HG1       GLU  23  16.876   0.322  28.313
  167    H    CYS  24           HN       CYS  24  15.527   3.362  25.056
  168    HA   CYS  24           HA       CYS  24  18.033   4.486  25.563
  169   1HB   CYS  24          HB2       CYS  24  15.843   5.416  23.698
  170   2HB   CYS  24          HB1       CYS  24  17.490   6.037  23.680
  171    HG   CYS  24           HG       CYS  24  18.304   4.318  21.966
  172    H    LEU  25           HN       LEU  25  14.815   5.614  26.342
  173    HA   LEU  25           HA       LEU  25  15.537   8.292  26.938
  174   1HB   LEU  25          HB2       LEU  25  13.148   6.626  27.693
  175   2HB   LEU  25          HB1       LEU  25  13.314   8.314  28.137
  176    HG   LEU  25           HG       LEU  25  13.292   7.286  25.297
  177   1HD1  LEU  25          HD11      LEU  25  11.059   8.252  25.164
  178   2HD1  LEU  25          HD12      LEU  25  11.129   8.671  26.876
  179   3HD1  LEU  25          HD13      LEU  25  11.125   6.978  26.382
  180   1HD2  LEU  25          HD21      LEU  25  14.553   9.347  25.554
  181   2HD2  LEU  25          HD22      LEU  25  13.209  10.081  26.429
  182   3HD2  LEU  25          HD23      LEU  25  13.027   9.660  24.726
  183    H    LYS  26           HN       LYS  26  16.037   5.391  28.687
  184    HA   LYS  26           HA       LYS  26  15.869   6.584  31.300
  185   1HB   LYS  26          HB2       LYS  26  16.451   4.495  32.173
  186   2HB   LYS  26          HB1       LYS  26  15.566   4.095  30.710
  187   1HG   LYS  26          HG2       LYS  26  17.818   3.898  29.567
  188   2HG   LYS  26          HG1       LYS  26  18.530   3.976  31.178
  189   1HD   LYS  26          HD2       LYS  26  16.507   1.935  30.259
  190   2HD   LYS  26          HD1       LYS  26  18.244   1.662  30.386
  191   1HE   LYS  26          HE2       LYS  26  18.129   2.109  32.792
  192   2HE   LYS  26          HE1       LYS  26  16.388   2.364  32.657
  193   1HZ   LYS  26          HZ1       LYS  26  17.806  -0.167  32.016
  194   2HZ   LYS  26          HZ2       LYS  26  16.132   0.080  31.932
  195   3HZ   LYS  26          HZ3       LYS  26  16.924   0.130  33.432
  196    H    ILE  27           HN       ILE  27  18.259   6.368  28.836
  197    HA   ILE  27           HA       ILE  27  20.268   7.425  30.720
  198    HB   ILE  27           HB       ILE  27  22.015   6.449  29.222
  199   1HG1  ILE  27          HG12      ILE  27  19.674   4.914  28.066
  200   2HG1  ILE  27          HG11      ILE  27  20.578   6.169  27.225
  201   1HG2  ILE  27          HG21      ILE  27  20.135   4.480  30.512
  202   2HG2  ILE  27          HG22      ILE  27  21.394   5.401  31.333
  203   3HG2  ILE  27          HG23      ILE  27  21.831   4.194  30.124
  204   1HD1  ILE  27          HD11      ILE  27  21.260   3.938  26.530
  205   2HD1  ILE  27          HD12      ILE  27  21.706   3.551  28.192
  206   3HD1  ILE  27          HD13      ILE  27  22.584   4.802  27.311
  207    H    GLY  28           HN       GLY  28  18.300   8.294  28.286
  208   1HA   GLY  28          HA2       GLY  28  18.245  10.200  26.984
  209   2HA   GLY  28          HA1       GLY  28  19.791  10.659  27.680
  210    H    SER  29           HN       SER  29  19.047   7.698  25.932
  211    HA   SER  29           HA       SER  29  21.271   8.224  24.138
  212   1HB   SER  29          HB2       SER  29  21.050   5.999  25.185
  213   2HB   SER  29          HB1       SER  29  19.483   5.789  24.405
  214    HG   SER  29           HG       SER  29  22.056   5.905  23.227
  215    HA   PRO  30           HA       PRO  30  18.469   9.592  20.944
  216   1HB   PRO  30          HB2       PRO  30  20.309   9.947  19.003
  217   2HB   PRO  30          HB1       PRO  30  20.141  11.065  20.361
  218   1HG   PRO  30          HG2       PRO  30  22.142   8.889  19.932
  219   2HG   PRO  30          HG1       PRO  30  22.374  10.510  20.612
  220   1HD   PRO  30          HD2       PRO  30  22.138   8.228  22.121
  221   2HD   PRO  30          HD1       PRO  30  21.729   9.853  22.704
  222    H    TRP  31           HN       TRP  31  17.328   8.554  19.422
  223    HA   TRP  31           HA       TRP  31  18.357   5.989  18.427
  224   1HB   TRP  31          HB2       TRP  31  15.934   5.492  17.943
  225   2HB   TRP  31          HB1       TRP  31  16.317   5.672  19.652
  226    HD1  TRP  31           HD1      TRP  31  14.732   7.731  16.772
  227    HE1  TRP  31           HE1      TRP  31  13.036   9.367  17.808
  228    HE3  TRP  31           HE3      TRP  31  15.561   6.737  21.719
  229    HZ2  TRP  31           HZ2      TRP  31  12.159  10.119  20.374
  230    HZ3  TRP  31           HZ3      TRP  31  14.246   7.959  23.401
  231    HH2  TRP  31           HH2      TRP  31  12.580   9.617  22.740
  232    H    VAL  32           HN       VAL  32  17.306   5.434  16.203
  233    HA   VAL  32           HA       VAL  32  17.678   7.785  14.476
  234    HB   VAL  32           HB       VAL  32  17.759   4.868  13.682
  235   1HG1  VAL  32          HG11      VAL  32  17.151   6.408  11.870
  236   2HG1  VAL  32          HG12      VAL  32  18.732   5.671  11.606
  237   3HG1  VAL  32          HG13      VAL  32  18.619   7.336  12.176
  238   1HG2  VAL  32          HG21      VAL  32  20.050   6.770  14.170
  239   2HG2  VAL  32          HG22      VAL  32  20.182   5.114  13.576
  240   3HG2  VAL  32          HG23      VAL  32  19.591   5.421  15.209
  241    H    HIS  33           HN       HIS  33  15.734   4.772  14.519
  242    HA   HIS  33           HA       HIS  33  13.397   6.400  13.789
  243   1HB   HIS  33          HB2       HIS  33  14.110   3.737  12.543
  244   2HB   HIS  33          HB1       HIS  33  12.613   4.618  12.272
  245    HD1  HIS  33           HD1      HIS  33  15.756   4.025  10.768
  246    HD2  HIS  33           HD2      HIS  33  13.295   7.365  11.138
  247    HE1  HIS  33           HE1      HIS  33  16.471   5.609   8.939
  248    HE2  HIS  33           HE2      HIS  33  14.958   7.615   9.163
  249    H    LEU  34           HN       LEU  34  11.350   5.386  14.300
  250    HA   LEU  34           HA       LEU  34  11.534   3.412  16.470
  251   1HB   LEU  34          HB2       LEU  34   9.816   5.891  16.389
  252   2HB   LEU  34          HB1       LEU  34   9.709   4.637  17.610
  253    HG   LEU  34           HG       LEU  34  12.163   6.320  17.119
  254   1HD1  LEU  34          HD11      LEU  34  11.517   7.459  19.204
  255   2HD1  LEU  34          HD12      LEU  34   9.993   6.571  19.189
  256   3HD1  LEU  34          HD13      LEU  34  10.358   7.716  17.900
  257   1HD2  LEU  34          HD21      LEU  34  12.624   4.131  18.109
  258   2HD2  LEU  34          HD22      LEU  34  11.426   4.443  19.365
  259   3HD2  LEU  34          HD23      LEU  34  12.887   5.427  19.276
  260    H    ARG  35           HN       ARG  35   9.822   2.002  16.675
  261    HA   ARG  35           HA       ARG  35   7.717   2.135  14.641
  262   1HB   ARG  35          HB2       ARG  35   8.048  -0.484  14.564
  263   2HB   ARG  35          HB1       ARG  35   8.991   0.581  13.535
  264   1HG   ARG  35          HG2       ARG  35  10.511  -0.985  14.400
  265   2HG   ARG  35          HG1       ARG  35  10.791   0.499  15.308
  266   1HD   ARG  35          HD2       ARG  35  10.772  -1.013  17.017
  267   2HD   ARG  35          HD1       ARG  35   9.063  -0.590  16.969
  268    HE   ARG  35           HE       ARG  35   9.394  -2.762  15.281
  269   1HH1  ARG  35          HH11      ARG  35   9.717  -2.032  18.683
  270   2HH1  ARG  35          HH12      ARG  35   9.562  -3.679  19.191
  271   1HH2  ARG  35          HH21      ARG  35   9.196  -4.942  15.925
  272   2HH2  ARG  35          HH22      ARG  35   9.253  -5.345  17.610
  273    H    ILE  36           HN       ILE  36   5.745   1.651  15.354
  274    HA   ILE  36           HA       ILE  36   5.484   0.626  18.095
  275    HB   ILE  36           HB       ILE  36   4.243   2.674  17.669
  276   1HG1  ILE  36          HG12      ILE  36   2.364   0.309  17.851
  277   2HG1  ILE  36          HG11      ILE  36   3.293   0.966  19.194
  278   1HG2  ILE  36          HG21      ILE  36   3.944   2.471  15.263
  279   2HG2  ILE  36          HG22      ILE  36   2.404   2.777  16.066
  280   3HG2  ILE  36          HG23      ILE  36   2.799   1.151  15.505
  281   1HD1  ILE  36          HD11      ILE  36   2.086   3.075  18.997
  282   2HD1  ILE  36          HD12      ILE  36   0.988   1.719  19.258
  283   3HD1  ILE  36          HD13      ILE  36   1.159   2.419  17.648
  284    H    CYS  37           HN       CYS  37   5.013  -1.363  18.431
  285    HA   CYS  37           HA       CYS  37   4.610  -3.194  16.261
  286   1HB   CYS  37          HB2       CYS  37   6.005  -3.684  18.217
  287   2HB   CYS  37          HB1       CYS  37   4.596  -3.557  19.255
  288    H    ARG  38           HN       ARG  38   2.668  -3.445  15.341
  289    HA   ARG  38           HA       ARG  38   0.315  -2.323  16.477
  290   1HB   ARG  38          HB2       ARG  38   0.725  -4.020  14.016
  291   2HB   ARG  38          HB1       ARG  38  -0.798  -3.256  14.439
  292   1HG   ARG  38          HG2       ARG  38   1.773  -1.776  13.934
  293   2HG   ARG  38          HG1       ARG  38   0.501  -2.026  12.738
  294   1HD   ARG  38          HD2       ARG  38   0.274  -0.508  15.335
  295   2HD   ARG  38          HD1       ARG  38   0.287   0.172  13.708
  296    HE   ARG  38           HE       ARG  38  -1.868  -1.615  14.638
  297   1HH1  ARG  38          HH11      ARG  38  -0.787   1.358  13.122
  298   2HH1  ARG  38          HH12      ARG  38  -2.397   1.871  12.717
  299   1HH2  ARG  38          HH21      ARG  38  -3.981  -0.908  14.107
  300   2HH2  ARG  38          HH22      ARG  38  -4.196   0.605  13.288
  301    H    THR  39           HN       THR  39   1.670  -5.092  17.437
  302    HA   THR  39           HA       THR  39  -0.838  -6.608  17.534
  303    HB   THR  39           HB       THR  39   1.889  -7.582  18.387
  304    HG1  THR  39           HG1      THR  39   0.670  -8.206  15.903
  305   1HG2  THR  39          HG21      THR  39  -0.008  -8.872  19.239
  306   2HG2  THR  39          HG22      THR  39   0.888  -9.796  18.033
  307   3HG2  THR  39          HG23      THR  39  -0.642  -9.033  17.601
  308    H    CYS  40           HN       CYS  40   1.499  -4.980  19.591
  309    HA   CYS  40           HA       CYS  40  -0.151  -5.695  21.911
  310   1HB   CYS  40          HB2       CYS  40   1.844  -6.039  23.281
  311   2HB   CYS  40          HB1       CYS  40   1.847  -7.129  21.900
  312    H    GLY  41           HN       GLY  41   1.569  -3.272  20.184
  313   1HA   GLY  41          HA2       GLY  41   1.144  -0.977  20.483
  314   2HA   GLY  41          HA1       GLY  41   0.628  -1.308  22.127
  315    H    HIS  42           HN       HIS  42   3.569  -2.830  21.416
  316    HA   HIS  42           HA       HIS  42   4.893  -0.927  23.165
  317   1HB   HIS  42          HB2       HIS  42   5.041  -3.502  23.381
  318   2HB   HIS  42          HB1       HIS  42   6.184  -3.407  22.045
  319    HD1  HIS  42           HD1      HIS  42   5.900  -2.955  25.684
  320    HD2  HIS  42           HD2      HIS  42   8.577  -1.914  22.679
  321    HE1  HIS  42           HE1      HIS  42   8.017  -2.290  26.860
  322    HE2  HIS  42           HE2      HIS  42   9.474  -1.343  25.034
  323    H    VAL  43           HN       VAL  43   6.272   0.555  22.527
  324    HA   VAL  43           HA       VAL  43   6.919   0.736  19.676
  325    HB   VAL  43           HB       VAL  43   7.352   2.798  21.855
  326   1HG1  VAL  43          HG11      VAL  43   7.520   4.383  19.995
  327   2HG1  VAL  43          HG12      VAL  43   7.330   3.058  18.846
  328   3HG1  VAL  43          HG13      VAL  43   8.753   3.127  19.886
  329   1HG2  VAL  43          HG21      VAL  43   4.976   2.286  21.652
  330   2HG2  VAL  43          HG22      VAL  43   5.055   2.546  19.909
  331   3HG2  VAL  43          HG23      VAL  43   5.325   3.893  21.015
  332    H    GLY  44           HN       GLY  44   9.001   0.612  18.917
  333   1HA   GLY  44          HA2       GLY  44  11.173   0.593  20.886
  334   2HA   GLY  44          HA1       GLY  44  10.985  -0.810  19.843
  335    H    CYS  45           HN       CYS  45  13.291   0.784  19.922
  336    HA   CYS  45           HA       CYS  45  13.326   2.480  17.616
  337   1HB   CYS  45          HB2       CYS  45  15.764   2.479  17.943
  338   2HB   CYS  45          HB1       CYS  45  14.923   2.790  19.459
  339    HG   CYS  45           HG       CYS  45  16.722   0.074  18.528
  340    H    CYS  46           HN       CYS  46  14.164   2.001  15.570
  341    HA   CYS  46           HA       CYS  46  13.691  -0.678  14.708
  342   1HB   CYS  46          HB2       CYS  46  14.815   1.703  13.222
  343   2HB   CYS  46          HB1       CYS  46  14.334   0.183  12.475
  344    HG   CYS  46           HG       CYS  46  12.344   2.019  11.917
  345    H    ASP  47           HN       ASP  47  15.432  -1.450  12.932
  346    HA   ASP  47           HA       ASP  47  17.567  -2.533  14.412
  347   1HB   ASP  47          HB2       ASP  47  16.676  -3.712  12.510
  348   2HB   ASP  47          HB1       ASP  47  17.060  -2.374  11.434
  349    H    ASP  48           HN       ASP  48  17.325   0.248  12.313
  350    HA   ASP  48           HA       ASP  48  20.004   0.896  11.959
  351   1HB   ASP  48          HB2       ASP  48  19.111   3.309  11.882
  352   2HB   ASP  48          HB1       ASP  48  18.475   2.159  10.711
  353    H    SER  49           HN       SER  49  17.956   1.337  14.752
  354    HA   SER  49           HA       SER  49  19.897   3.017  16.094
  355   1HB   SER  49          HB2       SER  49  17.358   1.784  17.184
  356   2HB   SER  49          HB1       SER  49  18.272   3.123  17.882
  357    HG   SER  49           HG       SER  49  17.289   3.304  15.240
  358    HA   PRO  50           HA       PRO  50  22.455  -0.164  17.550
  359   1HB   PRO  50          HB2       PRO  50  23.153   0.875  20.023
  360   2HB   PRO  50          HB1       PRO  50  23.900   1.305  18.482
  361   1HG   PRO  50          HG2       PRO  50  21.765   2.726  20.018
  362   2HG   PRO  50          HG1       PRO  50  23.142   3.398  19.124
  363   1HD   PRO  50          HD2       PRO  50  20.675   3.447  18.101
  364   2HD   PRO  50          HD1       PRO  50  22.088   3.142  17.068
  365    H    HIS  51           HN       HIS  51  19.797   0.788  19.631
  366    HA   HIS  51           HA       HIS  51  20.193  -1.420  21.445
  367   1HB   HIS  51          HB2       HIS  51  18.006   0.641  21.188
  368   2HB   HIS  51          HB1       HIS  51  17.934  -0.671  22.357
  369    HD1  HIS  51           HD1      HIS  51  18.708   0.023  24.607
  370    HD2  HIS  51           HD2      HIS  51  20.665   2.116  21.582
  371    HE1  HIS  51           HE1      HIS  51  20.212   1.667  25.773
  372    HE2  HIS  51           HE2      HIS  51  21.545   2.761  23.931
  373    H    LYS  52           HN       LYS  52  18.726  -1.008  18.428
  374    HA   LYS  52           HA       LYS  52  17.262  -2.238  17.157
  375   1HB   LYS  52          HB2       LYS  52  19.002  -4.389  18.354
  376   2HB   LYS  52          HB1       LYS  52  18.036  -4.560  16.896
  377   1HG   LYS  52          HG2       LYS  52  19.347  -2.744  15.857
  378   2HG   LYS  52          HG1       LYS  52  20.360  -2.690  17.303
  379   1HD   LYS  52          HD2       LYS  52  20.949  -5.058  16.940
  380   2HD   LYS  52          HD1       LYS  52  19.987  -5.047  15.459
  381   1HE   LYS  52          HE2       LYS  52  22.368  -3.279  16.001
  382   2HE   LYS  52          HE1       LYS  52  22.399  -4.753  15.034
  383   1HZ   LYS  52          HZ1       LYS  52  22.216  -2.823  13.622
  384   2HZ   LYS  52          HZ2       LYS  52  20.832  -2.301  14.440
  385   3HZ   LYS  52          HZ3       LYS  52  20.781  -3.726  13.528
  386    H    HIS  53           HN       HIS  53  15.639  -1.672  19.162
  387    HA   HIS  53           HA       HIS  53  14.700  -4.009  20.530
  388   1HB   HIS  53          HB2       HIS  53  13.758  -1.174  20.355
  389   2HB   HIS  53          HB1       HIS  53  12.692  -2.409  21.020
  390    HD1  HIS  53           HD1      HIS  53  15.059  -0.019  22.107
  391    HD2  HIS  53           HD2      HIS  53  14.229  -3.955  23.139
  392    HE1  HIS  53           HE1      HIS  53  16.084  -0.353  24.374
  393    HE2  HIS  53           HE2      HIS  53  15.750  -2.800  24.875
  394    H    ALA  54           HN       ALA  54  14.189  -2.700  17.446
  395    HA   ALA  54           HA       ALA  54  11.563  -3.656  16.988
  396   1HB   ALA  54          HB1       ALA  54  12.562  -1.942  15.594
  397   2HB   ALA  54          HB2       ALA  54  12.076  -3.331  14.619
  398   3HB   ALA  54          HB3       ALA  54  13.776  -3.090  15.023
  399    H    THR  55           HN       THR  55  14.768  -5.038  16.339
  400    HA   THR  55           HA       THR  55  13.688  -7.363  15.070
  401    HB   THR  55           HB       THR  55  16.116  -8.161  15.288
  402    HG1  THR  55           HG1      THR  55  17.597  -6.620  15.932
  403   1HG2  THR  55          HG21      THR  55  15.198  -7.184  13.235
  404   2HG2  THR  55          HG22      THR  55  16.869  -6.679  13.490
  405   3HG2  THR  55          HG23      THR  55  15.547  -5.567  13.847
  406    H    ARG  56           HN       ARG  56  15.286  -6.741  18.189
  407    HA   ARG  56           HA       ARG  56  15.269  -9.405  19.067
  408   1HB   ARG  56          HB2       ARG  56  15.295  -6.879  20.723
  409   2HB   ARG  56          HB1       ARG  56  15.701  -8.487  21.308
  410   1HG   ARG  56          HG2       ARG  56  17.524  -8.536  19.573
  411   2HG   ARG  56          HG1       ARG  56  17.196  -6.824  19.301
  412   1HD   ARG  56          HD2       ARG  56  19.025  -7.023  20.842
  413   2HD   ARG  56          HD1       ARG  56  17.616  -6.416  21.712
  414    HE   ARG  56           HE       ARG  56  17.627  -9.196  21.959
  415   1HH1  ARG  56          HH11      ARG  56  19.612  -6.468  22.948
  416   2HH1  ARG  56          HH12      ARG  56  20.203  -7.270  24.376
  417   1HH2  ARG  56          HH21      ARG  56  18.408 -10.230  23.851
  418   2HH2  ARG  56          HH22      ARG  56  19.526  -9.389  24.882
  419    H    HIS  57           HN       HIS  57  12.868  -6.835  19.427
  420    HA   HIS  57           HA       HIS  57  11.218  -8.165  21.283
  421   1HB   HIS  57          HB2       HIS  57  10.942  -5.784  20.833
  422   2HB   HIS  57          HB1       HIS  57  10.470  -6.128  19.173
  423    HD1  HIS  57           HD1      HIS  57   9.149  -6.190  22.698
  424    HD2  HIS  57           HD2      HIS  57   7.857  -7.010  18.821
  425    HE1  HIS  57           HE1      HIS  57   6.633  -6.455  22.815
  426    H    PHE  58           HN       PHE  58  11.388  -8.302  17.762
  427    HA   PHE  58           HA       PHE  58   9.000  -9.738  17.342
  428   1HB   PHE  58          HB2       PHE  58  10.103  -8.662  15.478
  429   2HB   PHE  58          HB1       PHE  58  11.545  -9.641  15.712
  430    HD1  PHE  58           HD1      PHE  58   7.945 -10.616  15.626
  431    HD2  PHE  58           HD2      PHE  58  11.774 -10.929  13.833
  432    HE1  PHE  58           HE1      PHE  58   7.073 -12.308  14.070
  433    HE2  PHE  58           HE2      PHE  58  10.919 -12.621  12.267
  434    HZ   PHE  58           HZ       PHE  58   8.560 -13.314  12.387
  435    H    HIS  59           HN       HIS  59  12.336 -10.798  17.874
  436    HA   HIS  59           HA       HIS  59  11.748 -13.570  17.600
  437   1HB   HIS  59          HB2       HIS  59  14.020 -12.441  17.360
  438   2HB   HIS  59          HB1       HIS  59  14.076 -12.395  19.119
  439    HD1  HIS  59           HD1      HIS  59  14.191 -14.758  16.218
  440    HD2  HIS  59           HD2      HIS  59  14.662 -14.834  20.349
  441    HE1  HIS  59           HE1      HIS  59  15.140 -17.024  16.750
  442    HE2  HIS  59           HE2      HIS  59  15.651 -16.941  19.214
  443    H    ALA  60           HN       ALA  60  11.565 -11.300  20.207
  444    HA   ALA  60           HA       ALA  60  11.559 -13.265  22.300
  445   1HB   ALA  60          HB1       ALA  60  10.773 -10.359  22.401
  446   2HB   ALA  60          HB2       ALA  60  12.399 -10.991  22.657
  447   3HB   ALA  60          HB3       ALA  60  11.106 -11.404  23.782
  448    H    THR  61           HN       THR  61   9.065 -11.340  20.647
  449    HA   THR  61           HA       THR  61   7.033 -12.694  22.281
  450    HB   THR  61           HB       THR  61   5.475 -10.944  21.304
  451    HG1  THR  61           HG1      THR  61   7.963  -9.748  20.565
  452   1HG2  THR  61          HG21      THR  61   6.389 -10.811  23.584
  453   2HG2  THR  61          HG22      THR  61   6.199  -9.215  22.857
  454   3HG2  THR  61          HG23      THR  61   7.799  -9.953  22.959
  455    H    GLY  62           HN       GLY  62   8.009 -12.167  18.942
  456   1HA   GLY  62          HA2       GLY  62   7.427 -13.498  17.103
  457   2HA   GLY  62          HA1       GLY  62   6.175 -14.259  18.078
  458    H    HIS  63           HN       HIS  63   6.817 -10.845  17.393
  459    HA   HIS  63           HA       HIS  63   4.081 -10.644  16.308
  460   1HB   HIS  63          HB2       HIS  63   5.673  -8.581  17.855
  461   2HB   HIS  63          HB1       HIS  63   4.139  -8.252  17.062
  462    HD2  HIS  63           HD2      HIS  63   3.245 -11.456  18.395
  463    HE1  HIS  63           HE1      HIS  63   2.924  -8.890  21.749
  464    HE2  HIS  63           HE2      HIS  63   2.121 -11.059  20.708
  465    HA   PRO  64           HA       PRO  64   6.891  -9.906  12.916
  466   1HB   PRO  64          HB2       PRO  64   5.316 -10.770  10.941
  467   2HB   PRO  64          HB1       PRO  64   6.003 -11.882  12.132
  468   1HG   PRO  64          HG2       PRO  64   3.240 -10.755  11.960
  469   2HG   PRO  64          HG1       PRO  64   3.758 -12.394  12.392
  470   1HD   PRO  64          HD2       PRO  64   3.065 -10.412  14.202
  471   2HD   PRO  64          HD1       PRO  64   4.053 -11.836  14.580
  472    H    ILE  65           HN       ILE  65   4.226  -7.977  13.618
  473    HA   ILE  65           HA       ILE  65   4.752  -6.376  11.204
  474    HB   ILE  65           HB       ILE  65   2.059  -6.754  12.514
  475   1HG1  ILE  65          HG12      ILE  65   3.148  -7.491   9.787
  476   2HG1  ILE  65          HG11      ILE  65   2.667  -8.604  11.063
  477   1HG2  ILE  65          HG21      ILE  65   1.200  -5.235  10.793
  478   2HG2  ILE  65          HG22      ILE  65   2.844  -4.953  10.220
  479   3HG2  ILE  65          HG23      ILE  65   2.371  -4.429  11.837
  480   1HD1  ILE  65          HD11      ILE  65   0.836  -6.751   9.559
  481   2HD1  ILE  65          HD12      ILE  65   0.355  -7.879  10.827
  482   3HD1  ILE  65          HD13      ILE  65   1.000  -8.489   9.304
  483    H    ILE  66           HN       ILE  66   5.306  -4.372  11.482
  484    HA   ILE  66           HA       ILE  66   4.665  -3.004  14.008
  485    HB   ILE  66           HB       ILE  66   6.871  -1.878  13.911
  486   1HG1  ILE  66          HG12      ILE  66   7.564  -3.967  11.831
  487   2HG1  ILE  66          HG11      ILE  66   7.213  -2.285  11.452
  488   1HG2  ILE  66          HG21      ILE  66   7.036  -4.884  14.057
  489   2HG2  ILE  66          HG22      ILE  66   6.491  -3.821  15.355
  490   3HG2  ILE  66          HG23      ILE  66   8.160  -3.739  14.791
  491   1HD1  ILE  66          HD11      ILE  66   9.600  -2.709  11.498
  492   2HD1  ILE  66          HD12      ILE  66   9.480  -3.271  13.166
  493   3HD1  ILE  66          HD13      ILE  66   9.134  -1.586  12.775
  494    H    GLU  67           HN       GLU  67   4.533  -0.705  13.820
  495    HA   GLU  67           HA       GLU  67   4.168   0.245  11.057
  496   1HB   GLU  67          HB2       GLU  67   2.046   0.147  12.219
  497   2HB   GLU  67          HB1       GLU  67   2.712   1.017  13.592
  498   1HG   GLU  67          HG2       GLU  67   2.915   3.023  12.287
  499   2HG   GLU  67          HG1       GLU  67   2.415   2.168  10.828
  500    H    GLY  68           HN       GLY  68   5.061   2.205  10.501
  501   1HA   GLY  68          HA2       GLY  68   7.308   3.109  11.994
  502   2HA   GLY  68          HA1       GLY  68   6.621   3.896  10.578
  503    H    TYR  69           HN       TYR  69   6.969   3.988  13.953
  504    HA   TYR  69           HA       TYR  69   4.676   5.716  14.405
  505   1HB   TYR  69          HB2       TYR  69   5.597   3.873  15.993
  506   2HB   TYR  69          HB1       TYR  69   6.794   5.084  16.444
  507    HD1  TYR  69           HD1      TYR  69   6.265   5.874  18.565
  508    HD2  TYR  69           HD2      TYR  69   3.142   5.324  15.731
  509    HE1  TYR  69           HE1      TYR  69   4.658   6.850  20.153
  510    HE2  TYR  69           HE2      TYR  69   1.528   6.294  17.307
  511    HH   TYR  69           HH       TYR  69   1.271   6.680  19.671
  512    H    ASP  70           HN       ASP  70   8.134   5.893  14.100
  513    HA   ASP  70           HA       ASP  70   8.307   8.658  14.865
  514   1HB   ASP  70          HB2       ASP  70  10.300   7.580  15.312
  515   2HB   ASP  70          HB1       ASP  70  10.223   6.612  13.846
  516    HA   PRO  71           HA       PRO  71   8.808   9.370  10.122
  517   1HB   PRO  71          HB2       PRO  71   8.007   7.379   8.446
  518   2HB   PRO  71          HB1       PRO  71   9.675   7.570   8.996
  519   1HG   PRO  71          HG2       PRO  71   7.547   5.725  10.000
  520   2HG   PRO  71          HG1       PRO  71   9.268   5.403   9.716
  521   1HD   PRO  71          HD2       PRO  71   8.263   5.875  12.182
  522   2HD   PRO  71          HD1       PRO  71   9.905   6.359  11.712
  523    HA   PRO  72           HA       PRO  72   4.411  10.246  10.450
  524   1HB   PRO  72          HB2       PRO  72   4.474  12.565   9.058
  525   2HB   PRO  72          HB1       PRO  72   5.039  12.439  10.728
  526   1HG   PRO  72          HG2       PRO  72   6.621  12.447   8.187
  527   2HG   PRO  72          HG1       PRO  72   6.950  13.286   9.714
  528   1HD   PRO  72          HD2       PRO  72   8.179  10.971   9.005
  529   2HD   PRO  72          HD1       PRO  72   7.853  11.413  10.693
  530    H    GLU  73           HN       GLU  73   5.381   8.405   8.413
  531    HA   GLU  73           HA       GLU  73   3.914   9.234   6.012
  532   1HB   GLU  73          HB2       GLU  73   5.685   6.834   6.508
  533   2HB   GLU  73          HB1       GLU  73   4.927   7.237   4.975
  534   1HG   GLU  73          HG2       GLU  73   6.269   9.155   4.706
  535   2HG   GLU  73          HG1       GLU  73   6.838   9.077   6.374
  536    H    GLY  74           HN       GLY  74   3.969   6.810   8.562
  537   1HA   GLY  74          HA2       GLY  74   2.257   5.483   9.360
  538   2HA   GLY  74          HA1       GLY  74   1.182   6.236   8.191
  539    H    TRP  75           HN       TRP  75   3.797   3.862   8.476
  540    HA   TRP  75           HA       TRP  75   2.366   2.191   6.562
  541   1HB   TRP  75          HB2       TRP  75   4.590   1.550   5.516
  542   2HB   TRP  75          HB1       TRP  75   3.972   3.144   5.106
  543    HD1  TRP  75           HD1      TRP  75   5.474   5.178   5.627
  544    HE1  TRP  75           HE1      TRP  75   7.827   5.486   6.623
  545    HE3  TRP  75           HE3      TRP  75   6.220   0.438   7.392
  546    HZ2  TRP  75           HZ2      TRP  75   9.742   3.917   7.984
  547    HZ3  TRP  75           HZ3      TRP  75   8.340  -0.075   8.527
  548    HH2  TRP  75           HH2      TRP  75  10.064   1.629   8.816
  549    H    GLY  76           HN       GLY  76   3.068  -0.055   6.603
  550   1HA   GLY  76          HA2       GLY  76   4.092  -0.789   9.272
  551   2HA   GLY  76          HA1       GLY  76   2.766  -1.634   8.486
  552    H    TRP  77           HN       TRP  77   5.508  -2.401   9.441
  553    HA   TRP  77           HA       TRP  77   6.507  -3.589   6.936
  554   1HB   TRP  77          HB2       TRP  77   8.165  -2.140   7.988
  555   2HB   TRP  77          HB1       TRP  77   7.964  -2.976   9.522
  556    HD1  TRP  77           HD1      TRP  77   9.337  -5.190   9.888
  557    HE1  TRP  77           HE1      TRP  77  11.165  -6.396   8.521
  558    HE3  TRP  77           HE3      TRP  77   8.882  -2.632   5.484
  559    HZ2  TRP  77           HZ2      TRP  77  12.259  -6.271   5.932
  560    HZ3  TRP  77           HZ3      TRP  77  10.359  -3.239   3.614
  561    HH2  TRP  77           HH2      TRP  77  12.012  -5.021   3.834
  562    H    CYS  78           HN       CYS  78   6.559  -5.762   6.776
  563    HA   CYS  78           HA       CYS  78   5.819  -7.296   9.184
  564   1HB   CYS  78          HB2       CYS  78   4.290  -7.273   7.087
  565   2HB   CYS  78          HB1       CYS  78   5.515  -8.306   6.366
  566    H    TYR  79           HN       TYR  79   7.496  -8.330  10.040
  567    HA   TYR  79           HA       TYR  79  10.053  -8.198   9.014
  568   1HB   TYR  79          HB2       TYR  79   8.898 -10.019  11.115
  569   2HB   TYR  79          HB1       TYR  79  10.621  -9.945  10.755
  570    HD1  TYR  79           HD1      TYR  79  11.779  -7.679  10.967
  571    HD2  TYR  79           HD2      TYR  79   7.929  -8.474  12.593
  572    HE1  TYR  79           HE1      TYR  79  12.022  -5.750  12.472
  573    HE2  TYR  79           HE2      TYR  79   8.161  -6.546  14.099
  574    HH   TYR  79           HH       TYR  79  10.735  -4.260  13.754
  575    H    VAL  80           HN       VAL  80   8.191 -11.253   9.251
  576    HA   VAL  80           HA       VAL  80  10.171 -12.712   7.850
  577    HB   VAL  80           HB       VAL  80   8.449 -14.530   7.722
  578   1HG1  VAL  80          HG11      VAL  80   9.995 -14.353   9.595
  579   2HG1  VAL  80          HG12      VAL  80   8.421 -14.940  10.133
  580   3HG1  VAL  80          HG13      VAL  80   8.883 -13.263  10.424
  581   1HG2  VAL  80          HG21      VAL  80   6.450 -13.133   7.594
  582   2HG2  VAL  80          HG22      VAL  80   6.752 -12.539   9.227
  583   3HG2  VAL  80          HG23      VAL  80   6.363 -14.240   8.965
  584    H    ASP  81           HN       ASP  81   7.544 -10.795   6.765
  585    HA   ASP  81           HA       ASP  81   7.382 -12.030   4.147
  586   1HB   ASP  81          HB2       ASP  81   6.172  -9.437   5.134
  587   2HB   ASP  81          HB1       ASP  81   5.786 -10.244   3.623
  588    H    GLU  82           HN       GLU  82   8.741  -9.203   5.673
  589    HA   GLU  82           HA       GLU  82  10.228  -7.630   5.062
  590   1HB   GLU  82          HB2       GLU  82  10.824  -9.495   2.761
  591   2HB   GLU  82          HB1       GLU  82  11.782  -8.081   3.187
  592   1HG   GLU  82          HG2       GLU  82  12.156  -9.104   5.427
  593   2HG   GLU  82          HG1       GLU  82  11.356 -10.558   4.836
  594    H    VAL  83           HN       VAL  83   7.440  -7.802   4.016
  595    HA   VAL  83           HA       VAL  83   7.709  -5.971   1.741
  596    HB   VAL  83           HB       VAL  83   5.344  -6.351   1.270
  597   1HG1  VAL  83          HG11      VAL  83   5.468  -8.726   0.607
  598   2HG1  VAL  83          HG12      VAL  83   6.924  -8.898   1.588
  599   3HG1  VAL  83          HG13      VAL  83   6.922  -7.818   0.193
  600   1HG2  VAL  83          HG21      VAL  83   5.397  -8.273   3.596
  601   2HG2  VAL  83          HG22      VAL  83   4.058  -8.059   2.468
  602   3HG2  VAL  83          HG23      VAL  83   4.533  -6.737   3.536
  603    H    MET  84           HN       MET  84   7.027  -3.924   1.870
  604    HA   MET  84           HA       MET  84   6.000  -3.013   4.470
  605   1HB   MET  84          HB2       MET  84   8.166  -2.049   3.730
  606   2HB   MET  84          HB1       MET  84   7.371  -1.415   2.296
  607   1HG   MET  84          HG2       MET  84   5.906  -0.063   3.747
  608   2HG   MET  84          HG1       MET  84   6.796  -0.651   5.149
  609   1HE   MET  84          HE1       MET  84   9.753  -0.770   4.031
  610   2HE   MET  84          HE2       MET  84   9.380  -0.078   5.610
  611   3HE   MET  84          HE3       MET  84  10.378   0.820   4.466
  612    H    PHE  85           HN       PHE  85   4.021  -2.181   4.588
  613    HA   PHE  85           HA       PHE  85   2.684  -1.349   2.102
  614   1HB   PHE  85          HB2       PHE  85   0.557  -2.319   3.080
  615   2HB   PHE  85          HB1       PHE  85   1.748  -3.500   2.551
  616    HD1  PHE  85           HD1      PHE  85   0.011  -2.051   5.414
  617    HD2  PHE  85           HD2      PHE  85   2.962  -4.853   4.167
  618    HE1  PHE  85           HE1      PHE  85  -0.065  -3.115   7.632
  619    HE2  PHE  85           HE2      PHE  85   2.893  -5.918   6.383
  620    HZ   PHE  85           HZ       PHE  85   1.379  -5.049   8.118
  621    H    ASP  86           HN       ASP  86   1.052   0.293   2.401
  622    HA   ASP  86           HA       ASP  86   1.808   2.057   4.561
  623   1HB   ASP  86          HB2       ASP  86   0.372   3.714   3.474
  624   2HB   ASP  86          HB1       ASP  86   1.486   2.989   2.322
  625    H    LEU  87           HN       LEU  87   0.508   2.822   6.177
  626    HA   LEU  87           HA       LEU  87  -1.995   1.335   6.631
  627   1HB   LEU  87          HB2       LEU  87   0.293   1.857   8.508
  628   2HB   LEU  87          HB1       LEU  87  -1.322   1.554   9.115
  629    HG   LEU  87           HG       LEU  87   0.226  -0.363   7.370
  630   1HD1  LEU  87          HD11      LEU  87  -0.248  -0.394  10.349
  631   2HD1  LEU  87          HD12      LEU  87   1.294  -0.088   9.549
  632   3HD1  LEU  87          HD13      LEU  87   0.528  -1.670   9.411
  633   1HD2  LEU  87          HD21      LEU  87  -1.501  -1.955   8.027
  634   2HD2  LEU  87          HD22      LEU  87  -2.207  -0.571   7.192
  635   3HD2  LEU  87          HD23      LEU  87  -2.323  -0.695   8.948
  636    H    SER  88           HN       SER  88  -1.402   4.062   5.587
  637    HA   SER  88           HA       SER  88  -1.672   6.080   7.458
  638   1HB   SER  88          HB2       SER  88  -2.901   6.131   4.699
  639   2HB   SER  88          HB1       SER  88  -2.301   7.499   5.637
  640    HG   SER  88           HG       SER  88  -0.972   6.061   3.894
  641    H    ASP  89           HN       ASP  89  -4.134   3.976   6.127
  642    HA   ASP  89           HA       ASP  89  -6.329   5.594   7.070
  643   1HB   ASP  89          HB2       ASP  89  -7.754   3.826   6.220
  644   2HB   ASP  89          HB1       ASP  89  -6.527   4.234   5.031
  645    H    ARG  90           HN       ARG  90  -4.357   3.119   8.367
  646    HA   ARG  90           HA       ARG  90  -6.224   2.784  10.637
  647   1HB   ARG  90          HB2       ARG  90  -4.099   0.849   9.696
  648   2HB   ARG  90          HB1       ARG  90  -5.179   0.608  11.057
  649   1HG   ARG  90          HG2       ARG  90  -7.090   0.594   9.497
  650   2HG   ARG  90          HG1       ARG  90  -5.953   0.738   8.151
  651   1HD   ARG  90          HD2       ARG  90  -4.850  -1.344   8.932
  652   2HD   ARG  90          HD1       ARG  90  -6.100  -1.505  10.162
  653    HE   ARG  90           HE       ARG  90  -6.767  -1.471   7.287
  654   1HH1  ARG  90          HH11      ARG  90  -6.899  -2.977  10.446
  655   2HH1  ARG  90          HH12      ARG  90  -7.961  -4.256   9.947
  656   1HH2  ARG  90          HH21      ARG  90  -8.141  -3.175   6.603
  657   2HH2  ARG  90          HH22      ARG  90  -8.654  -4.380   7.752
  658    H    MET  91           HN       MET  91  -3.840   4.672  10.002
  659    HA   MET  91           HA       MET  91  -1.611   3.759  11.459
  660   1HB   MET  91          HB2       MET  91  -0.660   5.953  11.119
  661   2HB   MET  91          HB1       MET  91  -1.449   5.412   9.646
  662   1HG   MET  91          HG2       MET  91  -3.379   6.828  10.177
  663   2HG   MET  91          HG1       MET  91  -2.554   7.386  11.631
  664   1HE   MET  91          HE1       MET  91   0.482   7.506  10.484
  665   2HE   MET  91          HE2       MET  91  -0.219   8.716  11.560
  666   3HE   MET  91          HE3       MET  91   0.572   9.217  10.066
  667    H    THR  92           HN       THR  92  -0.808   4.206  13.431
  668    HA   THR  92           HA       THR  92  -2.706   5.040  15.450
  669    HB   THR  92           HB       THR  92   0.195   4.369  15.924
  670    HG1  THR  92           HG1      THR  92  -0.519   2.613  14.794
  671   1HG2  THR  92          HG21      THR  92  -2.295   4.015  17.600
  672   2HG2  THR  92          HG22      THR  92  -1.068   5.262  17.822
  673   3HG2  THR  92          HG23      THR  92  -0.658   3.566  18.081
  674    HA   PRO  93           HA       PRO  93  -1.215   9.294  15.304
  675   1HB   PRO  93          HB2       PRO  93  -2.657  10.100  17.497
  676   2HB   PRO  93          HB1       PRO  93  -3.318  10.015  15.861
  677   1HG   PRO  93          HG2       PRO  93  -3.572   8.063  18.112
  678   2HG   PRO  93          HG1       PRO  93  -4.799   8.598  16.948
  679   1HD   PRO  93          HD2       PRO  93  -3.539   6.230  16.702
  680   2HD   PRO  93          HD1       PRO  93  -4.017   7.191  15.287
  681    H    HIS  94           HN       HIS  94   0.558  10.153  16.265
  682    HA   HIS  94           HA       HIS  94   1.805   8.677  18.374
  683   1HB   HIS  94          HB2       HIS  94   3.604  10.406  18.265
  684   2HB   HIS  94          HB1       HIS  94   3.277   9.612  16.735
  685    HD1  HIS  94           HD1      HIS  94   3.581  12.902  18.278
  686    HD2  HIS  94           HD2      HIS  94   1.802  11.303  14.873
  687    HE1  HIS  94           HE1      HIS  94   3.168  14.852  16.744
  688    HE2  HIS  94           HE2      HIS  94   1.972  13.881  14.750
  689    H    ASN  95           HN       ASN  95   1.737   8.967  20.465
  690    HA   ASN  95           HA       ASN  95  -0.210  10.882  21.455
  691   1HB   ASN  95          HB2       ASN  95  -0.135   9.591  23.519
  692   2HB   ASN  95          HB1       ASN  95  -0.322   8.515  22.139
  693   1HD2  ASN  95          HD21      ASN  95   0.663   7.931  24.796
  694   2HD2  ASN  95          HD22      ASN  95   2.269   7.313  24.597
  695    H    GLY  96           HN       GLY  96   2.775  11.408  20.728
  696   1HA   GLY  96          HA2       GLY  96   3.085  13.484  22.674
  697   2HA   GLY  96          HA1       GLY  96   4.265  12.195  22.876
  698    HA   PRO  97           HA       PRO  97   5.717  15.070  19.463
  699   1HB   PRO  97          HB2       PRO  97   7.442  16.499  21.271
  700   2HB   PRO  97          HB1       PRO  97   6.105  17.133  20.310
  701   1HG   PRO  97          HG2       PRO  97   6.101  16.969  23.056
  702   2HG   PRO  97          HG1       PRO  97   4.641  17.022  22.053
  703   1HD   PRO  97          HD2       PRO  97   5.986  14.671  23.328
  704   2HD   PRO  97          HD1       PRO  97   4.253  15.018  23.141
  705    H    ILE  98           HN       ILE  98   6.776  13.207  18.773
  706    HA   ILE  98           HA       ILE  98   8.926  12.054  20.274
  707    HB   ILE  98           HB       ILE  98   8.086  11.499  17.425
  708   1HG1  ILE  98          HG12      ILE  98   7.331  10.144  20.027
  709   2HG1  ILE  98          HG11      ILE  98   6.260  11.095  19.003
  710   1HG2  ILE  98          HG21      ILE  98   9.285   9.392  17.701
  711   2HG2  ILE  98          HG22      ILE  98   9.770   9.870  19.328
  712   3HG2  ILE  98          HG23      ILE  98  10.368  10.765  17.930
  713   1HD1  ILE  98          HD11      ILE  98   5.871   8.722  18.717
  714   2HD1  ILE  98          HD12      ILE  98   7.559   8.485  18.265
  715   3HD1  ILE  98          HD13      ILE  98   6.493   9.435  17.227
  716    HA   PRO  99           HA       PRO  99  11.973  14.891  18.642
  717   1HB   PRO  99          HB2       PRO  99  13.877  13.245  20.135
  718   2HB   PRO  99          HB1       PRO  99  13.452  14.943  20.358
  719   1HG   PRO  99          HG2       PRO  99  12.736  13.026  22.120
  720   2HG   PRO  99          HG1       PRO  99  11.743  14.463  21.815
  721   1HD   PRO  99          HD2       PRO  99  11.402  11.671  20.799
  722   2HD   PRO  99          HD1       PRO  99  10.175  12.825  21.357
  723    H    ARG 100           HN       ARG 100  12.163  14.357  16.495
  724    HA   ARG 100           HA       ARG 100  13.592  11.996  15.664
  725   1HB   ARG 100          HB2       ARG 100  11.963  12.781  14.120
  726   2HB   ARG 100          HB1       ARG 100  12.562  14.432  14.211
  727   1HG   ARG 100          HG2       ARG 100  13.167  13.399  12.103
  728   2HG   ARG 100          HG1       ARG 100  14.603  13.766  13.058
  729   1HD   ARG 100          HD2       ARG 100  15.058  11.639  12.285
  730   2HD   ARG 100          HD1       ARG 100  14.379  11.321  13.880
  731    HE   ARG 100           HE       ARG 100  12.513  10.370  12.891
  732   1HH1  ARG 100          HH11      ARG 100  14.583  11.867  10.483
  733   2HH1  ARG 100          HH12      ARG 100  13.807  11.082   9.139
  734   1HH2  ARG 100          HH21      ARG 100  11.543   9.281  11.144
  735   2HH2  ARG 100          HH22      ARG 100  12.073   9.604   9.511
  736    H    TYR 101           HN       TYR 101  15.725  11.808  15.774
  737    HA   TYR 101           HA       TYR 101  17.327  14.195  16.228
  738   1HB   TYR 101          HB2       TYR 101  18.074  11.270  16.405
  739   2HB   TYR 101          HB1       TYR 101  19.113  12.617  16.857
  740    HD1  TYR 101           HD1      TYR 101  18.205  14.207  18.694
  741    HD2  TYR 101           HD2      TYR 101  16.683  10.297  17.997
  742    HE1  TYR 101           HE1      TYR 101  17.264  14.177  20.965
  743    HE2  TYR 101           HE2      TYR 101  15.736  10.255  20.265
  744    HH   TYR 101           HH       TYR 101  16.104  11.346  22.437
  745    H    VAL 102           HN       VAL 102  16.834  11.749  13.785
  746    HA   VAL 102           HA       VAL 102  19.159  12.709  12.304
  747    HB   VAL 102           HB       VAL 102  18.601  10.811  10.708
  748   1HG1  VAL 102          HG11      VAL 102  19.595   9.116  12.191
  749   2HG1  VAL 102          HG12      VAL 102  19.288  10.166  13.573
  750   3HG1  VAL 102          HG13      VAL 102  20.413  10.674  12.313
  751   1HG2  VAL 102          HG21      VAL 102  17.232   8.983  11.605
  752   2HG2  VAL 102          HG22      VAL 102  16.278  10.448  11.367
  753   3HG2  VAL 102          HG23      VAL 102  16.799   9.989  12.988
  Start of MODEL   20
    1   1H    MET   1          HT1       MET   1   6.241   0.887  -1.706
    2   2H    MET   1          HT2       MET   1   5.008   0.528  -2.815
    3   3H    MET   1          HT3       MET   1   6.277  -0.568  -2.576
    4    HA   MET   1           HA       MET   1   5.586  -1.011  -0.353
    5   1HB   MET   1          HB2       MET   1   3.623   0.000   0.611
    6   2HB   MET   1          HB1       MET   1   4.690   1.286   0.066
    7   1HG   MET   1          HG2       MET   1   3.324   1.618  -1.909
    8   2HG   MET   1          HG1       MET   1   2.283   0.277  -1.436
    9   1HE   MET   1          HE1       MET   1   0.079   1.687  -1.570
   10   2HE   MET   1          HE2       MET   1   1.044   3.031  -2.183
   11   3HE   MET   1          HE3       MET   1  -0.098   3.294  -0.864
   12    H    THR   2           HN       THR   2   3.387  -2.145   0.217
   13    HA   THR   2           HA       THR   2   2.051  -3.115  -2.207
   14    HB   THR   2           HB       THR   2   3.745  -4.799  -1.584
   15    HG1  THR   2           HG1      THR   2   2.382  -6.431  -1.912
   16   1HG2  THR   2          HG21      THR   2   3.904  -4.364   0.805
   17   2HG2  THR   2          HG22      THR   2   3.521  -6.061   0.514
   18   3HG2  THR   2          HG23      THR   2   2.256  -4.949   1.038
   19    H    MET   3           HN       MET   3   0.148  -4.689  -1.253
   20    HA   MET   3           HA       MET   3  -1.479  -2.876   0.322
   21   1HB   MET   3          HB2       MET   3  -2.101  -5.529  -0.983
   22   2HB   MET   3          HB1       MET   3  -3.275  -4.592  -0.069
   23   1HG   MET   3          HG2       MET   3  -2.999  -2.736  -1.649
   24   2HG   MET   3          HG1       MET   3  -1.862  -3.712  -2.577
   25   1HE   MET   3          HE1       MET   3  -6.330  -4.767  -2.069
   26   2HE   MET   3          HE2       MET   3  -5.583  -3.326  -1.378
   27   3HE   MET   3          HE3       MET   3  -5.145  -4.923  -0.772
   28    H    GLY   4           HN       GLY   4   0.395  -5.718   0.801
   29   1HA   GLY   4          HA2       GLY   4   0.963  -5.794   3.292
   30   2HA   GLY   4          HA1       GLY   4  -0.766  -6.045   3.485
   31    H    CYS   5           HN       CYS   5  -0.310  -8.013   4.518
   32    HA   CYS   5           HA       CYS   5  -0.145 -10.211   2.637
   33   1HB   CYS   5          HB2       CYS   5   1.528 -11.437   3.956
   34   2HB   CYS   5          HB1       CYS   5   2.196  -9.930   3.341
   35    H    ARG   6           HN       ARG   6  -0.678 -12.332   3.893
   36    HA   ARG   6           HA       ARG   6  -3.177 -11.930   5.103
   37   1HB   ARG   6          HB2       ARG   6  -3.186 -14.320   5.546
   38   2HB   ARG   6          HB1       ARG   6  -2.572 -13.993   3.933
   39   1HG   ARG   6          HG2       ARG   6  -0.277 -14.276   4.780
   40   2HG   ARG   6          HG1       ARG   6  -0.940 -14.688   6.363
   41   1HD   ARG   6          HD2       ARG   6  -1.407 -16.174   3.784
   42   2HD   ARG   6          HD1       ARG   6  -0.387 -16.699   5.124
   43    HE   ARG   6           HE       ARG   6  -2.904 -16.286   6.194
   44   1HH1  ARG   6          HH11      ARG   6  -1.480 -18.323   3.724
   45   2HH1  ARG   6          HH12      ARG   6  -2.615 -19.624   3.965
   46   1HH2  ARG   6          HH21      ARG   6  -4.396 -17.975   6.508
   47   2HH2  ARG   6          HH22      ARG   6  -4.280 -19.423   5.558
   48    H    HIS   7           HN       HIS   7  -0.007 -12.045   6.495
   49    HA   HIS   7           HA       HIS   7  -0.595 -12.552   9.177
   50   1HB   HIS   7          HB2       HIS   7   1.489 -10.733   7.956
   51   2HB   HIS   7          HB1       HIS   7   1.410 -11.093   9.674
   52    HD2  HIS   7           HD2      HIS   7   1.038 -14.315   9.524
   53    HE1  HIS   7           HE1      HIS   7   4.625 -14.144   7.290
   54    HE2  HIS   7           HE2      HIS   7   3.215 -15.557   8.846
   55    H    VAL   8           HN       VAL   8  -1.322  -9.810   7.214
   56    HA   VAL   8           HA       VAL   8  -1.432  -7.789   9.160
   57    HB   VAL   8           HB       VAL   8  -1.695  -7.807   6.465
   58   1HG1  VAL   8          HG11      VAL   8  -3.999  -8.609   6.524
   59   2HG1  VAL   8          HG12      VAL   8  -3.894  -6.984   5.846
   60   3HG1  VAL   8          HG13      VAL   8  -4.457  -7.213   7.502
   61   1HG2  VAL   8          HG21      VAL   8  -2.654  -5.621   8.301
   62   2HG2  VAL   8          HG22      VAL   8  -2.150  -5.422   6.623
   63   3HG2  VAL   8          HG23      VAL   8  -0.980  -5.930   7.841
   64    H    ALA   9           HN       ALA   9  -3.647 -10.354   8.386
   65    HA   ALA   9           HA       ALA   9  -5.957  -9.205   9.590
   66   1HB   ALA   9          HB1       ALA   9  -5.327 -12.108   9.074
   67   2HB   ALA   9          HB2       ALA   9  -6.095 -11.002   7.935
   68   3HB   ALA   9          HB3       ALA   9  -6.916 -11.433   9.435
   69    H    GLY  10           HN       GLY  10  -3.106 -10.225  10.964
   70   1HA   GLY  10          HA2       GLY  10  -4.405 -11.164  13.431
   71   2HA   GLY  10          HA1       GLY  10  -2.721 -11.425  13.003
   72    H    ILE  11           HN       ILE  11  -3.321  -8.321  12.167
   73    HA   ILE  11           HA       ILE  11  -2.296  -7.336  14.736
   74    HB   ILE  11           HB       ILE  11  -1.559  -5.342  13.549
   75   1HG1  ILE  11          HG12      ILE  11  -2.654  -6.696  11.075
   76   2HG1  ILE  11          HG11      ILE  11  -3.345  -5.277  11.848
   77   1HG2  ILE  11          HG21      ILE  11  -0.068  -7.265  13.693
   78   2HG2  ILE  11          HG22      ILE  11   0.194  -6.369  12.197
   79   3HG2  ILE  11          HG23      ILE  11  -0.708  -7.885  12.171
   80   1HD1  ILE  11          HD11      ILE  11  -1.376  -3.988  11.301
   81   2HD1  ILE  11          HD12      ILE  11  -2.050  -4.732   9.848
   82   3HD1  ILE  11          HD13      ILE  11  -0.610  -5.416  10.605
   83    H    ARG  12           HN       ARG  12  -3.145  -5.368  15.627
   84    HA   ARG  12           HA       ARG  12  -5.855  -4.723  14.714
   85   1HB   ARG  12          HB2       ARG  12  -6.635  -4.716  17.070
   86   2HB   ARG  12          HB1       ARG  12  -6.173  -6.305  16.487
   87   1HG   ARG  12          HG2       ARG  12  -5.126  -6.425  18.466
   88   2HG   ARG  12          HG1       ARG  12  -3.857  -5.540  17.620
   89   1HD   ARG  12          HD2       ARG  12  -4.390  -4.560  19.815
   90   2HD   ARG  12          HD1       ARG  12  -4.695  -3.442  18.486
   91    HE   ARG  12           HE       ARG  12  -7.111  -4.573  18.847
   92   1HH1  ARG  12          HH11      ARG  12  -4.853  -3.177  21.128
   93   2HH1  ARG  12          HH12      ARG  12  -6.094  -2.575  22.184
   94   1HH2  ARG  12          HH21      ARG  12  -8.745  -3.763  20.225
   95   2HH2  ARG  12          HH22      ARG  12  -8.296  -2.915  21.675
   96    H    THR  13           HN       THR  13  -6.643  -2.823  16.391
   97    HA   THR  13           HA       THR  13  -4.849  -0.636  15.781
   98    HB   THR  13           HB       THR  13  -7.441  -0.500  17.334
   99    HG1  THR  13           HG1      THR  13  -7.932   0.206  14.874
  100   1HG2  THR  13          HG21      THR  13  -5.979   1.524  15.630
  101   2HG2  THR  13          HG22      THR  13  -6.058   1.522  17.392
  102   3HG2  THR  13          HG23      THR  13  -7.522   1.786  16.444
  103    H    VAL  14           HN       VAL  14  -3.116  -0.462  17.085
  104    HA   VAL  14           HA       VAL  14  -3.370  -1.269  19.878
  105    HB   VAL  14           HB       VAL  14  -0.884  -1.235  19.887
  106   1HG1  VAL  14          HG11      VAL  14  -2.084  -3.295  19.455
  107   2HG1  VAL  14          HG12      VAL  14  -0.624  -3.226  18.467
  108   3HG1  VAL  14          HG13      VAL  14  -2.197  -2.895  17.741
  109   1HG2  VAL  14          HG21      VAL  14  -1.237  -0.633  16.951
  110   2HG2  VAL  14          HG22      VAL  14   0.277  -1.127  17.708
  111   3HG2  VAL  14          HG23      VAL  14  -0.472   0.407  18.153
  112    H    THR  15           HN       THR  15  -2.092  -0.103  21.491
  113    HA   THR  15           HA       THR  15  -2.150   2.811  21.053
  114    HB   THR  15           HB       THR  15  -2.736   1.334  23.634
  115    HG1  THR  15           HG1      THR  15  -4.356   2.259  21.545
  116   1HG2  THR  15          HG21      THR  15  -2.993   4.264  22.936
  117   2HG2  THR  15          HG22      THR  15  -1.754   3.559  23.974
  118   3HG2  THR  15          HG23      THR  15  -3.446   3.522  24.471
  119    HA   PRO  16           HA       PRO  16   2.174   2.365  22.062
  120   1HB   PRO  16          HB2       PRO  16   2.809   4.994  22.084
  121   2HB   PRO  16          HB1       PRO  16   2.531   4.091  20.592
  122   1HG   PRO  16          HG2       PRO  16   0.693   5.934  22.062
  123   2HG   PRO  16          HG1       PRO  16   0.969   5.783  20.317
  124   1HD   PRO  16          HD2       PRO  16  -1.168   4.682  21.599
  125   2HD   PRO  16          HD1       PRO  16  -0.461   4.000  20.121
  126    H    SER  17           HN       SER  17   3.372   2.362  23.898
  127    HA   SER  17           HA       SER  17   2.179   3.634  26.266
  128   1HB   SER  17          HB2       SER  17   2.256   1.155  26.310
  129   2HB   SER  17          HB1       SER  17   4.009   1.223  26.138
  130    HG   SER  17           HG       SER  17   3.770   2.663  28.142
  131    H    ALA  18           HN       ALA  18   4.420   4.376  24.138
  132    HA   ALA  18           HA       ALA  18   6.086   5.736  26.090
  133   1HB   ALA  18          HB1       ALA  18   7.297   3.908  24.013
  134   2HB   ALA  18          HB2       ALA  18   7.263   3.612  25.751
  135   3HB   ALA  18          HB3       ALA  18   8.187   4.969  25.105
  136    H    LEU  19           HN       LEU  19   7.048   7.600  25.288
  137    HA   LEU  19           HA       LEU  19   5.757   8.784  23.041
  138   1HB   LEU  19          HB2       LEU  19   8.196   9.716  24.560
  139   2HB   LEU  19          HB1       LEU  19   7.266  10.687  23.436
  140    HG   LEU  19           HG       LEU  19   6.291   9.607  26.080
  141   1HD1  LEU  19          HD11      LEU  19   7.858  11.458  26.300
  142   2HD1  LEU  19          HD12      LEU  19   6.223  11.961  26.730
  143   3HD1  LEU  19          HD13      LEU  19   6.903  12.414  25.167
  144   1HD2  LEU  19          HD21      LEU  19   4.490   9.652  24.440
  145   2HD2  LEU  19          HD22      LEU  19   4.881  11.325  24.040
  146   3HD2  LEU  19          HD23      LEU  19   4.271  10.921  25.645
  147    H    GLY  20           HN       GLY  20   9.079   7.717  23.627
  148   1HA   GLY  20          HA2       GLY  20   9.419   7.446  20.716
  149   2HA   GLY  20          HA1       GLY  20  10.674   8.181  21.707
  150    H    CYS  21           HN       CYS  21  12.272   6.669  21.406
  151    HA   CYS  21           HA       CYS  21  11.744   3.872  21.653
  152   1HB   CYS  21          HB2       CYS  21  13.591   4.665  20.257
  153   2HB   CYS  21          HB1       CYS  21  14.381   5.353  21.673
  154    HG   CYS  21           HG       CYS  21  15.902   3.211  21.439
  155    H    GLU  22           HN       GLU  22  11.050   3.170  23.518
  156    HA   GLU  22           HA       GLU  22  11.349   4.089  26.055
  157   1HB   GLU  22          HB2       GLU  22   9.857   2.279  25.493
  158   2HB   GLU  22          HB1       GLU  22  11.210   1.234  25.086
  159   1HG   GLU  22          HG2       GLU  22  11.930   1.404  27.481
  160   2HG   GLU  22          HG1       GLU  22  10.397   2.220  27.802
  161    H    GLU  23           HN       GLU  23  13.552   1.875  24.378
  162    HA   GLU  23           HA       GLU  23  15.252   1.325  26.537
  163   1HB   GLU  23          HB2       GLU  23  15.173   0.090  24.350
  164   2HB   GLU  23          HB1       GLU  23  16.026   1.442  23.617
  165   1HG   GLU  23          HG2       GLU  23  17.687  -0.121  24.058
  166   2HG   GLU  23          HG1       GLU  23  17.824   1.041  25.376
  167    H    CYS  24           HN       CYS  24  15.556   3.720  23.930
  168    HA   CYS  24           HA       CYS  24  17.988   4.803  24.859
  169   1HB   CYS  24          HB2       CYS  24  15.882   6.080  23.106
  170   2HB   CYS  24          HB1       CYS  24  17.557   6.601  23.260
  171    HG   CYS  24           HG       CYS  24  18.509   5.083  21.427
  172    H    LEU  25           HN       LEU  25  14.632   5.518  25.560
  173    HA   LEU  25           HA       LEU  25  15.011   8.058  26.731
  174   1HB   LEU  25          HB2       LEU  25  12.843   5.994  27.004
  175   2HB   LEU  25          HB1       LEU  25  12.784   7.528  27.851
  176    HG   LEU  25           HG       LEU  25  12.945   7.258  24.848
  177   1HD1  LEU  25          HD11      LEU  25  10.581   7.901  24.860
  178   2HD1  LEU  25          HD12      LEU  25  10.569   7.810  26.621
  179   3HD1  LEU  25          HD13      LEU  25  10.842   6.353  25.665
  180   1HD2  LEU  25          HD21      LEU  25  12.328   9.626  24.871
  181   2HD2  LEU  25          HD22      LEU  25  13.854   9.351  25.709
  182   3HD2  LEU  25          HD23      LEU  25  12.377   9.623  26.634
  183    H    LYS  26           HN       LYS  26  15.674   4.891  27.948
  184    HA   LYS  26           HA       LYS  26  15.247   5.512  30.704
  185   1HB   LYS  26          HB2       LYS  26  16.060   3.363  31.197
  186   2HB   LYS  26          HB1       LYS  26  15.256   3.190  29.644
  187   1HG   LYS  26          HG2       LYS  26  17.552   3.472  28.595
  188   2HG   LYS  26          HG1       LYS  26  18.197   3.248  30.222
  189   1HD   LYS  26          HD2       LYS  26  16.429   1.303  28.745
  190   2HD   LYS  26          HD1       LYS  26  18.173   1.151  28.959
  191   1HE   LYS  26          HE2       LYS  26  17.906   0.960  31.350
  192   2HE   LYS  26          HE1       LYS  26  16.175   1.269  31.218
  193   1HZ   LYS  26          HZ1       LYS  26  17.584  -1.073  30.049
  194   2HZ   LYS  26          HZ2       LYS  26  15.913  -0.784  30.004
  195   3HZ   LYS  26          HZ3       LYS  26  16.682  -1.094  31.485
  196    H    ILE  27           HN       ILE  27  17.857   6.041  28.503
  197    HA   ILE  27           HA       ILE  27  19.556   6.878  30.768
  198    HB   ILE  27           HB       ILE  27  21.532   6.381  29.303
  199   1HG1  ILE  27          HG12      ILE  27  19.481   4.860  27.676
  200   2HG1  ILE  27          HG11      ILE  27  20.299   6.330  27.158
  201   1HG2  ILE  27          HG21      ILE  27  20.851   4.913  31.135
  202   2HG2  ILE  27          HG22      ILE  27  21.544   4.002  29.794
  203   3HG2  ILE  27          HG23      ILE  27  19.797   4.028  30.032
  204   1HD1  ILE  27          HD11      ILE  27  21.619   3.690  27.746
  205   2HD1  ILE  27          HD12      ILE  27  22.439   5.162  27.225
  206   3HD1  ILE  27          HD13      ILE  27  21.294   4.362  26.148
  207    H    GLY  28           HN       GLY  28  17.907   7.887  28.035
  208   1HA   GLY  28          HA2       GLY  28  17.816  10.022  27.107
  209   2HA   GLY  28          HA1       GLY  28  19.241  10.459  28.045
  210    H    SER  29           HN       SER  29  18.546   7.965  25.632
  211    HA   SER  29           HA       SER  29  21.017   8.718  24.233
  212   1HB   SER  29          HB2       SER  29  20.799   6.375  25.113
  213   2HB   SER  29          HB1       SER  29  19.426   6.144  24.036
  214    HG   SER  29           HG       SER  29  22.093   6.767  23.255
  215    HA   PRO  30           HA       PRO  30  18.502  10.180  20.865
  216   1HB   PRO  30          HB2       PRO  30  20.343  10.141  18.883
  217   2HB   PRO  30          HB1       PRO  30  20.370  11.340  20.182
  218   1HG   PRO  30          HG2       PRO  30  21.976   8.833  19.886
  219   2HG   PRO  30          HG1       PRO  30  22.500  10.441  20.417
  220   1HD   PRO  30          HD2       PRO  30  21.967   8.413  22.145
  221   2HD   PRO  30          HD1       PRO  30  21.728  10.122  22.558
  222    H    TRP  31           HN       TRP  31  17.659   9.522  18.797
  223    HA   TRP  31           HA       TRP  31  18.239   6.816  17.907
  224   1HB   TRP  31          HB2       TRP  31  15.812   6.249  17.809
  225   2HB   TRP  31          HB1       TRP  31  16.416   6.422  19.451
  226    HD1  TRP  31           HD1      TRP  31  14.428   8.521  16.852
  227    HE1  TRP  31           HE1      TRP  31  12.786  10.023  18.144
  228    HE3  TRP  31           HE3      TRP  31  15.800   7.311  21.626
  229    HZ2  TRP  31           HZ2      TRP  31  12.146  10.603  20.824
  230    HZ3  TRP  31           HZ3      TRP  31  14.616   8.381  23.497
  231    HH2  TRP  31           HH2      TRP  31  12.827   9.994  23.103
  232    H    VAL  32           HN       VAL  32  17.196   6.369  15.786
  233    HA   VAL  32           HA       VAL  32  17.248   8.772  14.153
  234    HB   VAL  32           HB       VAL  32  16.990   5.882  13.294
  235   1HG1  VAL  32          HG11      VAL  32  17.657   8.356  11.704
  236   2HG1  VAL  32          HG12      VAL  32  16.152   7.440  11.617
  237   3HG1  VAL  32          HG13      VAL  32  17.666   6.702  11.090
  238   1HG2  VAL  32          HG21      VAL  32  19.091   6.277  14.453
  239   2HG2  VAL  32          HG22      VAL  32  19.415   7.670  13.422
  240   3HG2  VAL  32          HG23      VAL  32  19.370   6.050  12.726
  241    H    HIS  33           HN       HIS  33  15.117   5.899  14.089
  242    HA   HIS  33           HA       HIS  33  12.799   7.674  14.226
  243   1HB   HIS  33          HB2       HIS  33  13.160   5.561  12.084
  244   2HB   HIS  33          HB1       HIS  33  11.650   6.402  12.412
  245    HD1  HIS  33           HD1      HIS  33  11.720   9.087  11.966
  246    HD2  HIS  33           HD2      HIS  33  14.828   6.835  10.346
  247    HE1  HIS  33           HE1      HIS  33  12.828  10.568  10.268
  248    HE2  HIS  33           HE2      HIS  33  14.755   9.226   9.356
  249    H    LEU  34           HN       LEU  34  10.745   6.301  14.515
  250    HA   LEU  34           HA       LEU  34  11.429   4.208  16.463
  251   1HB   LEU  34          HB2       LEU  34   9.085   6.109  16.439
  252   2HB   LEU  34          HB1       LEU  34   9.264   4.780  17.565
  253    HG   LEU  34           HG       LEU  34   9.941   6.640  18.784
  254   1HD1  LEU  34          HD11      LEU  34  11.539   4.831  18.986
  255   2HD1  LEU  34          HD12      LEU  34  12.347   6.393  19.126
  256   3HD1  LEU  34          HD13      LEU  34  12.463   5.472  17.626
  257   1HD2  LEU  34          HD21      LEU  34  11.532   7.554  16.394
  258   2HD2  LEU  34          HD22      LEU  34  11.470   8.363  17.960
  259   3HD2  LEU  34          HD23      LEU  34  10.016   8.248  16.969
  260    H    ARG  35           HN       ARG  35  10.225   2.371  16.602
  261    HA   ARG  35           HA       ARG  35   8.271   1.860  14.451
  262   1HB   ARG  35          HB2       ARG  35  10.365  -0.023  15.564
  263   2HB   ARG  35          HB1       ARG  35   9.078  -0.502  14.469
  264   1HG   ARG  35          HG2       ARG  35   9.980   0.861  12.717
  265   2HG   ARG  35          HG1       ARG  35  11.189   1.538  13.813
  266   1HD   ARG  35          HD2       ARG  35  12.223  -0.626  14.073
  267   2HD   ARG  35          HD1       ARG  35  10.965  -1.382  13.102
  268    HE   ARG  35           HE       ARG  35  12.191   0.627  11.578
  269   1HH1  ARG  35          HH11      ARG  35  12.849  -2.555  12.894
  270   2HH1  ARG  35          HH12      ARG  35  14.100  -2.905  11.735
  271   1HH2  ARG  35          HH21      ARG  35  13.795   0.135  10.023
  272   2HH2  ARG  35          HH22      ARG  35  14.625  -1.396  10.111
  273    H    ILE  36           HN       ILE  36   6.386   0.966  15.113
  274    HA   ILE  36           HA       ILE  36   6.241  -0.076  17.872
  275    HB   ILE  36           HB       ILE  36   5.158   2.127  17.764
  276   1HG1  ILE  36          HG12      ILE  36   3.157  -0.135  17.970
  277   2HG1  ILE  36          HG11      ILE  36   4.225   0.409  19.261
  278   1HG2  ILE  36          HG21      ILE  36   3.392   0.905  15.646
  279   2HG2  ILE  36          HG22      ILE  36   4.595   2.170  15.398
  280   3HG2  ILE  36          HG23      ILE  36   3.168   2.492  16.383
  281   1HD1  ILE  36          HD11      ILE  36   2.023   2.011  17.981
  282   2HD1  ILE  36          HD12      ILE  36   3.106   2.586  19.249
  283   3HD1  ILE  36          HD13      ILE  36   1.986   1.263  19.578
  284    H    CYS  37           HN       CYS  37   5.172  -2.029  18.097
  285    HA   CYS  37           HA       CYS  37   4.602  -3.597  15.804
  286   1HB   CYS  37          HB2       CYS  37   3.577  -3.962  18.619
  287   2HB   CYS  37          HB1       CYS  37   3.443  -5.147  17.335
  288    H    ARG  38           HN       ARG  38   2.667  -4.079  14.791
  289    HA   ARG  38           HA       ARG  38   0.337  -2.499  15.517
  290   1HB   ARG  38          HB2       ARG  38   0.867  -4.493  13.315
  291   2HB   ARG  38          HB1       ARG  38  -0.713  -3.769  13.587
  292   1HG   ARG  38          HG2       ARG  38   1.830  -2.317  12.892
  293   2HG   ARG  38          HG1       ARG  38   0.438  -2.586  11.838
  294   1HD   ARG  38          HD2       ARG  38   0.577  -0.891  14.322
  295   2HD   ARG  38          HD1       ARG  38   0.280  -0.359  12.667
  296    HE   ARG  38           HE       ARG  38  -1.642  -2.180  13.922
  297   1HH1  ARG  38          HH11      ARG  38  -0.844   1.016  12.730
  298   2HH1  ARG  38          HH12      ARG  38  -2.504   1.553  12.741
  299   1HH2  ARG  38          HH21      ARG  38  -3.810  -1.451  13.967
  300   2HH2  ARG  38          HH22      ARG  38  -4.172   0.169  13.455
  301    H    THR  39           HN       THR  39   1.717  -5.008  16.847
  302    HA   THR  39           HA       THR  39  -0.670  -6.630  17.273
  303    HB   THR  39           HB       THR  39   1.982  -7.336  18.448
  304    HG1  THR  39           HG1      THR  39   1.709  -8.368  15.942
  305   1HG2  THR  39          HG21      THR  39   0.063  -8.757  18.892
  306   2HG2  THR  39          HG22      THR  39   1.224  -9.609  17.874
  307   3HG2  THR  39          HG23      THR  39  -0.239  -8.927  17.162
  308    H    CYS  40           HN       CYS  40   2.053  -5.547  19.342
  309    HA   CYS  40           HA       CYS  40   0.213  -5.617  21.601
  310   1HB   CYS  40          HB2       CYS  40   2.099  -5.845  23.034
  311   2HB   CYS  40          HB1       CYS  40   2.380  -6.901  21.662
  312    H    GLY  41           HN       GLY  41   2.295  -3.346  19.880
  313   1HA   GLY  41          HA2       GLY  41   1.841  -1.026  19.815
  314   2HA   GLY  41          HA1       GLY  41   0.955  -1.186  21.322
  315    H    HIS  42           HN       HIS  42   3.934  -2.777  21.462
  316    HA   HIS  42           HA       HIS  42   4.996  -0.764  23.241
  317   1HB   HIS  42          HB2       HIS  42   5.148  -3.367  23.474
  318   2HB   HIS  42          HB1       HIS  42   6.508  -3.214  22.369
  319    HD1  HIS  42           HD1      HIS  42   5.612  -3.017  25.891
  320    HD2  HIS  42           HD2      HIS  42   8.661  -1.541  23.468
  321    HE1  HIS  42           HE1      HIS  42   7.458  -2.335  27.457
  322    HE2  HIS  42           HE2      HIS  42   9.274  -1.392  25.986
  323    H    VAL  43           HN       VAL  43   6.562   0.678  22.761
  324    HA   VAL  43           HA       VAL  43   7.225   0.955  19.943
  325    HB   VAL  43           HB       VAL  43   7.813   2.888  22.189
  326   1HG1  VAL  43          HG11      VAL  43   9.106   3.262  20.155
  327   2HG1  VAL  43          HG12      VAL  43   7.931   4.553  20.408
  328   3HG1  VAL  43          HG13      VAL  43   7.617   3.299  19.208
  329   1HG2  VAL  43          HG21      VAL  43   5.399   2.793  20.378
  330   2HG2  VAL  43          HG22      VAL  43   5.771   4.072  21.536
  331   3HG2  VAL  43          HG23      VAL  43   5.414   2.442  22.106
  332    H    GLY  44           HN       GLY  44   9.273   1.054  19.107
  333   1HA   GLY  44          HA2       GLY  44  11.583   0.969  20.893
  334   2HA   GLY  44          HA1       GLY  44  11.374  -0.400  19.807
  335    H    CYS  45           HN       CYS  45  13.664   1.006  19.511
  336    HA   CYS  45           HA       CYS  45  13.265   2.983  17.417
  337   1HB   CYS  45          HB2       CYS  45  15.674   3.310  17.517
  338   2HB   CYS  45          HB1       CYS  45  15.009   3.339  19.147
  339    HG   CYS  45           HG       CYS  45  17.051   1.061  17.704
  340    H    CYS  46           HN       CYS  46  14.217   2.773  15.323
  341    HA   CYS  46           HA       CYS  46  13.900   0.319  14.033
  342   1HB   CYS  46          HB2       CYS  46  15.607   2.676  13.202
  343   2HB   CYS  46          HB1       CYS  46  15.077   1.375  12.142
  344    HG   CYS  46           HG       CYS  46  13.530   3.557  11.498
  345    H    ASP  47           HN       ASP  47  15.573  -0.991  12.945
  346    HA   ASP  47           HA       ASP  47  17.638  -1.694  14.809
  347   1HB   ASP  47          HB2       ASP  47  18.184  -3.507  13.275
  348   2HB   ASP  47          HB1       ASP  47  16.446  -3.432  13.535
  349    H    ASP  48           HN       ASP  48  17.436   0.606  12.421
  350    HA   ASP  48           HA       ASP  48  20.076   0.639  11.431
  351   1HB   ASP  48          HB2       ASP  48  18.282   2.008  10.443
  352   2HB   ASP  48          HB1       ASP  48  18.203   2.968  11.917
  353    H    SER  49           HN       SER  49  18.554   2.156  14.235
  354    HA   SER  49           HA       SER  49  20.949   3.308  15.250
  355   1HB   SER  49          HB2       SER  49  18.379   2.648  16.716
  356   2HB   SER  49          HB1       SER  49  19.625   3.782  17.241
  357    HG   SER  49           HG       SER  49  19.086   4.680  14.946
  358    HA   PRO  50           HA       PRO  50  23.201  -0.196  16.598
  359   1HB   PRO  50          HB2       PRO  50  23.631   1.523  19.009
  360   2HB   PRO  50          HB1       PRO  50  24.804   0.595  18.066
  361   1HG   PRO  50          HG2       PRO  50  24.573   3.222  17.725
  362   2HG   PRO  50          HG1       PRO  50  24.847   2.145  16.344
  363   1HD   PRO  50          HD2       PRO  50  22.387   3.593  17.151
  364   2HD   PRO  50          HD1       PRO  50  22.925   3.084  15.539
  365    H    HIS  51           HN       HIS  51  21.106   1.308  19.061
  366    HA   HIS  51           HA       HIS  51  21.042  -0.782  20.901
  367   1HB   HIS  51          HB2       HIS  51  19.404   1.569  20.313
  368   2HB   HIS  51          HB1       HIS  51  18.484   0.247  21.020
  369    HD1  HIS  51           HD1      HIS  51  19.789   3.166  22.182
  370    HD2  HIS  51           HD2      HIS  51  20.486  -0.778  23.314
  371    HE1  HIS  51           HE1      HIS  51  20.525   3.267  24.591
  372    HE2  HIS  51           HE2      HIS  51  20.938   0.870  25.260
  373    H    LYS  52           HN       LYS  52  19.097  -0.272  18.013
  374    HA   LYS  52           HA       LYS  52  17.507  -1.505  16.951
  375   1HB   LYS  52          HB2       LYS  52  19.222  -3.841  17.799
  376   2HB   LYS  52          HB1       LYS  52  18.187  -3.739  16.381
  377   1HG   LYS  52          HG2       LYS  52  19.683  -1.802  15.652
  378   2HG   LYS  52          HG1       LYS  52  20.799  -2.367  16.895
  379   1HD   LYS  52          HD2       LYS  52  19.792  -3.914  14.514
  380   2HD   LYS  52          HD1       LYS  52  21.429  -3.315  14.775
  381   1HE   LYS  52          HE2       LYS  52  21.641  -4.798  16.723
  382   2HE   LYS  52          HE1       LYS  52  20.015  -5.411  16.420
  383   1HZ   LYS  52          HZ1       LYS  52  21.416  -6.958  15.422
  384   2HZ   LYS  52          HZ2       LYS  52  22.453  -5.776  14.792
  385   3HZ   LYS  52          HZ3       LYS  52  20.912  -5.993  14.119
  386    H    HIS  53           HN       HIS  53  16.368  -0.861  19.215
  387    HA   HIS  53           HA       HIS  53  15.834  -3.001  21.006
  388   1HB   HIS  53          HB2       HIS  53  15.685  -0.524  21.537
  389   2HB   HIS  53          HB1       HIS  53  14.149  -0.517  20.678
  390    HD1  HIS  53           HD1      HIS  53  12.274  -0.582  22.312
  391    HD2  HIS  53           HD2      HIS  53  15.518  -2.845  23.583
  392    HE1  HIS  53           HE1      HIS  53  11.597  -1.547  24.529
  393    HE2  HIS  53           HE2      HIS  53  13.644  -2.764  25.360
  394    H    ALA  54           HN       ALA  54  14.324  -1.916  18.060
  395    HA   ALA  54           HA       ALA  54  11.802  -3.155  18.478
  396   1HB   ALA  54          HB1       ALA  54  12.141  -1.350  16.850
  397   2HB   ALA  54          HB2       ALA  54  11.411  -2.779  16.118
  398   3HB   ALA  54          HB3       ALA  54  13.122  -2.436  15.866
  399    H    THR  55           HN       THR  55  14.791  -4.217  16.887
  400    HA   THR  55           HA       THR  55  13.666  -6.654  15.933
  401    HB   THR  55           HB       THR  55  16.175  -7.275  15.702
  402    HG1  THR  55           HG1      THR  55  17.515  -5.840  16.461
  403   1HG2  THR  55          HG21      THR  55  15.017  -4.905  14.228
  404   2HG2  THR  55          HG22      THR  55  14.757  -6.603  13.828
  405   3HG2  THR  55          HG23      THR  55  16.367  -5.898  13.679
  406    H    ARG  56           HN       ARG  56  15.649  -5.775  18.749
  407    HA   ARG  56           HA       ARG  56  15.964  -8.333  19.833
  408   1HB   ARG  56          HB2       ARG  56  15.602  -5.706  21.292
  409   2HB   ARG  56          HB1       ARG  56  16.153  -7.197  22.038
  410   1HG   ARG  56          HG2       ARG  56  18.107  -7.168  20.489
  411   2HG   ARG  56          HG1       ARG  56  17.578  -5.573  19.942
  412   1HD   ARG  56          HD2       ARG  56  17.694  -4.785  22.288
  413   2HD   ARG  56          HD1       ARG  56  18.338  -6.356  22.754
  414    HE   ARG  56           HE       ARG  56  19.722  -4.484  20.935
  415   1HH1  ARG  56          HH11      ARG  56  19.753  -6.934  23.440
  416   2HH1  ARG  56          HH12      ARG  56  21.471  -6.832  23.702
  417   1HH2  ARG  56          HH21      ARG  56  21.992  -4.324  21.304
  418   2HH2  ARG  56          HH22      ARG  56  22.739  -5.361  22.490
  419    H    HIS  57           HN       HIS  57  13.394  -5.948  20.320
  420    HA   HIS  57           HA       HIS  57  11.808  -7.515  22.036
  421   1HB   HIS  57          HB2       HIS  57  11.437  -5.159  21.976
  422   2HB   HIS  57          HB1       HIS  57  11.163  -5.177  20.238
  423    HD1  HIS  57           HD1      HIS  57   9.424  -5.749  23.507
  424    HD2  HIS  57           HD2      HIS  57   8.658  -6.069  19.428
  425    HE1  HIS  57           HE1      HIS  57   6.915  -6.053  23.262
  426    H    PHE  58           HN       PHE  58  11.923  -7.236  18.514
  427    HA   PHE  58           HA       PHE  58   9.645  -8.727  17.885
  428   1HB   PHE  58          HB2       PHE  58  10.710  -7.591  16.102
  429   2HB   PHE  58          HB1       PHE  58  12.266  -8.334  16.447
  430    HD1  PHE  58           HD1      PHE  58   8.892  -9.880  15.998
  431    HD2  PHE  58           HD2      PHE  58  12.866  -9.483  14.554
  432    HE1  PHE  58           HE1      PHE  58   8.454 -11.621  14.317
  433    HE2  PHE  58           HE2      PHE  58  12.441 -11.222  12.872
  434    HZ   PHE  58           HZ       PHE  58  10.230 -12.296  12.751
  435    H    HIS  59           HN       HIS  59  12.977  -9.806  18.486
  436    HA   HIS  59           HA       HIS  59  12.383 -12.563  18.097
  437   1HB   HIS  59          HB2       HIS  59  14.686 -11.106  19.369
  438   2HB   HIS  59          HB1       HIS  59  14.582 -12.863  19.412
  439    HD1  HIS  59           HD1      HIS  59  15.044 -14.133  17.247
  440    HD2  HIS  59           HD2      HIS  59  15.188 -10.000  16.814
  441    HE1  HIS  59           HE1      HIS  59  16.065 -13.723  14.980
  442    HE2  HIS  59           HE2      HIS  59  16.256 -11.212  14.790
  443    H    ALA  60           HN       ALA  60  12.090 -10.400  20.780
  444    HA   ALA  60           HA       ALA  60  12.002 -12.410  22.808
  445   1HB   ALA  60          HB1       ALA  60  11.099  -9.536  22.889
  446   2HB   ALA  60          HB2       ALA  60  12.707 -10.133  23.303
  447   3HB   ALA  60          HB3       ALA  60  11.315 -10.592  24.284
  448    H    THR  61           HN       THR  61   9.511 -10.510  21.107
  449    HA   THR  61           HA       THR  61   7.467 -12.068  22.548
  450    HB   THR  61           HB       THR  61   5.912 -10.197  21.808
  451    HG1  THR  61           HG1      THR  61   8.439  -9.031  21.184
  452   1HG2  THR  61          HG21      THR  61   6.736 -10.391  24.103
  453   2HG2  THR  61          HG22      THR  61   6.622  -8.701  23.613
  454   3HG2  THR  61          HG23      THR  61   8.194  -9.501  23.661
  455    H    GLY  62           HN       GLY  62   8.906 -11.884  19.543
  456   1HA   GLY  62          HA2       GLY  62   8.371 -12.778  17.500
  457   2HA   GLY  62          HA1       GLY  62   7.095 -13.662  18.324
  458    H    HIS  63           HN       HIS  63   7.696 -10.222  17.591
  459    HA   HIS  63           HA       HIS  63   5.000 -10.133  16.403
  460   1HB   HIS  63          HB2       HIS  63   6.435  -7.966  17.957
  461   2HB   HIS  63          HB1       HIS  63   4.945  -7.710  17.055
  462    HD2  HIS  63           HD2      HIS  63   3.709 -10.688  18.182
  463    HE1  HIS  63           HE1      HIS  63   3.750  -8.547  21.822
  464    HE2  HIS  63           HE2      HIS  63   3.044 -10.696  20.687
  465    HA   PRO  64           HA       PRO  64   7.989  -9.332  13.099
  466   1HB   PRO  64          HB2       PRO  64   6.568 -10.427  11.099
  467   2HB   PRO  64          HB1       PRO  64   7.401 -11.417  12.305
  468   1HG   PRO  64          HG2       PRO  64   4.507 -10.668  12.140
  469   2HG   PRO  64          HG1       PRO  64   5.235 -12.238  12.525
  470   1HD   PRO  64          HD2       PRO  64   4.289 -10.497  14.410
  471   2HD   PRO  64          HD1       PRO  64   5.580 -11.674  14.717
  472    H    ILE  65           HN       ILE  65   4.757  -8.143  13.430
  473    HA   ILE  65           HA       ILE  65   5.140  -6.435  11.075
  474    HB   ILE  65           HB       ILE  65   2.582  -7.099  12.530
  475   1HG1  ILE  65          HG12      ILE  65   3.596  -7.781   9.760
  476   2HG1  ILE  65          HG11      ILE  65   3.452  -8.902  11.109
  477   1HG2  ILE  65          HG21      ILE  65   2.509  -4.800  11.755
  478   2HG2  ILE  65          HG22      ILE  65   1.475  -5.804  10.738
  479   3HG2  ILE  65          HG23      ILE  65   3.059  -5.295  10.154
  480   1HD1  ILE  65          HD11      ILE  65   1.637  -9.180   9.528
  481   2HD1  ILE  65          HD12      ILE  65   1.180  -7.489   9.732
  482   3HD1  ILE  65          HD13      ILE  65   1.031  -8.613  11.083
  483    H    ILE  66           HN       ILE  66   5.741  -4.496  11.350
  484    HA   ILE  66           HA       ILE  66   5.054  -3.055  13.827
  485    HB   ILE  66           HB       ILE  66   7.158  -1.738  13.415
  486   1HG1  ILE  66          HG12      ILE  66   7.788  -4.024  11.534
  487   2HG1  ILE  66          HG11      ILE  66   7.357  -2.399  11.017
  488   1HG2  ILE  66          HG21      ILE  66   8.653  -3.440  14.361
  489   2HG2  ILE  66          HG22      ILE  66   7.483  -4.691  13.941
  490   3HG2  ILE  66          HG23      ILE  66   7.066  -3.458  15.131
  491   1HD1  ILE  66          HD11      ILE  66   9.348  -1.520  12.082
  492   2HD1  ILE  66          HD12      ILE  66   9.752  -2.780  10.916
  493   3HD1  ILE  66          HD13      ILE  66   9.773  -3.137  12.644
  494    H    GLU  67           HN       GLU  67   5.106  -0.660  13.494
  495    HA   GLU  67           HA       GLU  67   4.490   0.169  10.750
  496   1HB   GLU  67          HB2       GLU  67   2.357  -0.156  11.919
  497   2HB   GLU  67          HB1       GLU  67   2.902   0.880  13.228
  498   1HG   GLU  67          HG2       GLU  67   2.885   2.800  11.801
  499   2HG   GLU  67          HG1       GLU  67   2.551   1.802  10.387
  500    H    GLY  68           HN       GLY  68   4.982   2.370  10.319
  501   1HA   GLY  68          HA2       GLY  68   7.243   3.384  11.706
  502   2HA   GLY  68          HA1       GLY  68   6.333   4.228  10.463
  503    H    TYR  69           HN       TYR  69   6.986   3.952  13.782
  504    HA   TYR  69           HA       TYR  69   4.600   5.263  14.716
  505   1HB   TYR  69          HB2       TYR  69   5.830   3.573  16.059
  506   2HB   TYR  69          HB1       TYR  69   7.189   4.685  16.172
  507    HD1  TYR  69           HD1      TYR  69   7.367   5.889  18.124
  508    HD2  TYR  69           HD2      TYR  69   3.504   4.708  16.795
  509    HE1  TYR  69           HE1      TYR  69   6.375   6.888  20.139
  510    HE2  TYR  69           HE2      TYR  69   2.504   5.701  18.805
  511    HH   TYR  69           HH       TYR  69   4.467   7.488  21.145
  512    H    ASP  70           HN       ASP  70   7.853   6.156  13.871
  513    HA   ASP  70           HA       ASP  70   7.666   8.793  14.995
  514   1HB   ASP  70          HB2       ASP  70   9.840   7.773  14.931
  515   2HB   ASP  70          HB1       ASP  70   9.737   7.526  13.195
  516    HA   PRO  71           HA       PRO  71   7.013  10.148  10.455
  517   1HB   PRO  71          HB2       PRO  71   6.494   7.841   8.788
  518   2HB   PRO  71          HB1       PRO  71   7.781   9.039   8.640
  519   1HG   PRO  71          HG2       PRO  71   8.222   6.436   9.321
  520   2HG   PRO  71          HG1       PRO  71   9.272   7.773   9.824
  521   1HD   PRO  71          HD2       PRO  71   7.117   6.371  11.364
  522   2HD   PRO  71          HD1       PRO  71   8.727   6.893  11.900
  523    HA   PRO  72           HA       PRO  72   2.646   9.551  11.387
  524   1HB   PRO  72          HB2       PRO  72   2.242  12.149  10.141
  525   2HB   PRO  72          HB1       PRO  72   2.072  11.692  11.837
  526   1HG   PRO  72          HG2       PRO  72   4.047  13.322  10.938
  527   2HG   PRO  72          HG1       PRO  72   4.238  12.254  12.340
  528   1HD   PRO  72          HD2       PRO  72   5.177  11.865   9.521
  529   2HD   PRO  72          HD1       PRO  72   6.019  11.524  11.049
  530    H    GLU  73           HN       GLU  73   3.749   8.455   8.928
  531    HA   GLU  73           HA       GLU  73   1.921   9.300   6.820
  532   1HB   GLU  73          HB2       GLU  73   4.029   7.133   6.809
  533   2HB   GLU  73          HB1       GLU  73   3.160   7.739   5.407
  534   1HG   GLU  73          HG2       GLU  73   4.199   9.923   5.701
  535   2HG   GLU  73          HG1       GLU  73   5.063   9.323   7.117
  536    H    GLY  74           HN       GLY  74   2.731   6.360   8.631
  537   1HA   GLY  74          HA2       GLY  74   1.151   4.772   9.389
  538   2HA   GLY  74          HA1       GLY  74   0.000   5.396   8.215
  539    H    TRP  75           HN       TRP  75   3.151   3.754   8.350
  540    HA   TRP  75           HA       TRP  75   2.142   1.919   6.311
  541   1HB   TRP  75          HB2       TRP  75   4.481   1.839   5.333
  542   2HB   TRP  75          HB1       TRP  75   3.559   3.298   5.005
  543    HD1  TRP  75           HD1      TRP  75   4.519   5.568   5.873
  544    HE1  TRP  75           HE1      TRP  75   6.753   6.261   6.943
  545    HE3  TRP  75           HE3      TRP  75   6.339   0.926   7.012
  546    HZ2  TRP  75           HZ2      TRP  75   8.988   5.000   8.125
  547    HZ3  TRP  75           HZ3      TRP  75   8.532   0.759   8.111
  548    HH2  TRP  75           HH2      TRP  75   9.829   2.753   8.656
  549    H    GLY  76           HN       GLY  76   2.934  -0.184   6.432
  550   1HA   GLY  76          HA2       GLY  76   4.110  -0.789   9.071
  551   2HA   GLY  76          HA1       GLY  76   2.889  -1.783   8.291
  552    H    TRP  77           HN       TRP  77   5.483  -2.533   9.275
  553    HA   TRP  77           HA       TRP  77   6.655  -3.543   6.768
  554   1HB   TRP  77          HB2       TRP  77   8.151  -1.867   7.758
  555   2HB   TRP  77          HB1       TRP  77   8.121  -2.725   9.293
  556    HD1  TRP  77           HD1      TRP  77   9.664  -4.881   9.526
  557    HE1  TRP  77           HE1      TRP  77  11.607  -5.802   8.098
  558    HE3  TRP  77           HE3      TRP  77   8.958  -2.086   5.304
  559    HZ2  TRP  77           HZ2      TRP  77  12.687  -5.386   5.532
  560    HZ3  TRP  77           HZ3      TRP  77  10.493  -2.407   3.409
  561    HH2  TRP  77           HH2      TRP  77  12.319  -4.024   3.522
  562    H    CYS  78           HN       CYS  78   6.927  -5.696   6.682
  563    HA   CYS  78           HA       CYS  78   6.312  -7.228   9.127
  564   1HB   CYS  78          HB2       CYS  78   4.812  -7.456   7.060
  565   2HB   CYS  78          HB1       CYS  78   6.166  -8.259   6.291
  566    H    TYR  79           HN       TYR  79   8.218  -7.726  10.060
  567    HA   TYR  79           HA       TYR  79  10.720  -7.651   8.946
  568   1HB   TYR  79          HB2       TYR  79   9.649  -9.173  11.296
  569   2HB   TYR  79          HB1       TYR  79  11.336  -9.337  10.826
  570    HD1  TYR  79           HD1      TYR  79  12.479  -6.918  10.357
  571    HD2  TYR  79           HD2      TYR  79   9.220  -7.669  12.988
  572    HE1  TYR  79           HE1      TYR  79  13.061  -4.905  11.642
  573    HE2  TYR  79           HE2      TYR  79   9.788  -5.652  14.273
  574    HH   TYR  79           HH       TYR  79  11.712  -4.230  14.697
  575    H    VAL  80           HN       VAL  80   8.805 -10.621   9.399
  576    HA   VAL  80           HA       VAL  80  10.779 -12.305   8.279
  577    HB   VAL  80           HB       VAL  80   8.970 -14.029   8.209
  578   1HG1  VAL  80          HG11      VAL  80  10.359 -13.716  10.192
  579   2HG1  VAL  80          HG12      VAL  80   8.714 -14.164  10.641
  580   3HG1  VAL  80          HG13      VAL  80   9.244 -12.488  10.790
  581   1HG2  VAL  80          HG21      VAL  80   7.276 -11.809   9.356
  582   2HG2  VAL  80          HG22      VAL  80   6.806 -13.502   9.204
  583   3HG2  VAL  80          HG23      VAL  80   7.082 -12.531   7.758
  584    H    ASP  81           HN       ASP  81   8.404 -10.311   6.809
  585    HA   ASP  81           HA       ASP  81   8.440 -11.857   4.317
  586   1HB   ASP  81          HB2       ASP  81   6.818  -9.435   5.118
  587   2HB   ASP  81          HB1       ASP  81   6.739 -10.196   3.539
  588    H    GLU  82           HN       GLU  82   9.516  -8.876   5.732
  589    HA   GLU  82           HA       GLU  82  10.991  -7.284   5.093
  590   1HB   GLU  82          HB2       GLU  82  11.540  -9.132   2.769
  591   2HB   GLU  82          HB1       GLU  82  12.450  -7.668   3.113
  592   1HG   GLU  82          HG2       GLU  82  13.105  -8.617   5.287
  593   2HG   GLU  82          HG1       GLU  82  12.248 -10.102   4.870
  594    H    VAL  83           HN       VAL  83   8.164  -7.470   4.150
  595    HA   VAL  83           HA       VAL  83   8.370  -5.654   1.851
  596    HB   VAL  83           HB       VAL  83   6.042  -6.190   1.314
  597   1HG1  VAL  83          HG11      VAL  83   7.810  -7.490   0.270
  598   2HG1  VAL  83          HG12      VAL  83   6.379  -8.486   0.540
  599   3HG1  VAL  83          HG13      VAL  83   7.775  -8.638   1.608
  600   1HG2  VAL  83          HG21      VAL  83   4.870  -8.021   2.436
  601   2HG2  VAL  83          HG22      VAL  83   5.227  -6.706   3.557
  602   3HG2  VAL  83          HG23      VAL  83   6.203  -8.175   3.581
  603    H    MET  84           HN       MET  84   7.315  -3.721   1.860
  604    HA   MET  84           HA       MET  84   6.246  -2.835   4.460
  605   1HB   MET  84          HB2       MET  84   8.215  -1.584   3.633
  606   2HB   MET  84          HB1       MET  84   7.328  -1.175   2.171
  607   1HG   MET  84          HG2       MET  84   5.668   0.018   3.560
  608   2HG   MET  84          HG1       MET  84   6.658  -0.322   4.978
  609   1HE   MET  84          HE1       MET  84   9.595  -0.032   3.724
  610   2HE   MET  84          HE2       MET  84   9.149   0.633   5.296
  611   3HE   MET  84          HE3       MET  84   9.952   1.653   4.103
  612    H    PHE  85           HN       PHE  85   4.161  -2.203   4.593
  613    HA   PHE  85           HA       PHE  85   2.680  -1.916   2.076
  614   1HB   PHE  85          HB2       PHE  85   0.778  -3.169   3.190
  615   2HB   PHE  85          HB1       PHE  85   2.165  -4.129   2.697
  616    HD1  PHE  85           HD1      PHE  85   0.238  -2.853   5.519
  617    HD2  PHE  85           HD2      PHE  85   3.639  -5.122   4.341
  618    HE1  PHE  85           HE1      PHE  85   0.402  -3.782   7.788
  619    HE2  PHE  85           HE2      PHE  85   3.810  -6.052   6.610
  620    HZ   PHE  85           HZ       PHE  85   2.191  -5.383   8.339
  621    H    ASP  86           HN       ASP  86   0.550  -0.907   2.347
  622    HA   ASP  86           HA       ASP  86   0.869   1.456   3.962
  623   1HB   ASP  86          HB2       ASP  86   0.061   1.803   1.747
  624   2HB   ASP  86          HB1       ASP  86  -1.212   0.602   1.952
  625    H    LEU  87           HN       LEU  87  -0.007   1.859   5.856
  626    HA   LEU  87           HA       LEU  87  -2.348   0.298   6.725
  627   1HB   LEU  87          HB2       LEU  87   0.138   0.998   8.270
  628   2HB   LEU  87          HB1       LEU  87  -1.364   0.588   9.071
  629    HG   LEU  87           HG       LEU  87   0.178  -1.229   7.217
  630   1HD1  LEU  87          HD11      LEU  87   0.650  -2.497   9.265
  631   2HD1  LEU  87          HD12      LEU  87  -0.149  -1.246  10.216
  632   3HD1  LEU  87          HD13      LEU  87   1.329  -0.871   9.330
  633   1HD2  LEU  87          HD21      LEU  87  -2.223  -1.637   7.127
  634   2HD2  LEU  87          HD22      LEU  87  -2.287  -1.720   8.888
  635   3HD2  LEU  87          HD23      LEU  87  -1.401  -2.944   7.979
  636    H    SER  88           HN       SER  88  -1.872   3.065   5.553
  637    HA   SER  88           HA       SER  88  -1.929   4.996   7.585
  638   1HB   SER  88          HB2       SER  88  -1.377   5.290   5.098
  639   2HB   SER  88          HB1       SER  88  -3.118   5.413   4.847
  640    HG   SER  88           HG       SER  88  -1.499   7.078   6.495
  641    H    ASP  89           HN       ASP  89  -4.484   3.047   6.259
  642    HA   ASP  89           HA       ASP  89  -6.616   4.758   7.190
  643   1HB   ASP  89          HB2       ASP  89  -6.635   1.893   6.225
  644   2HB   ASP  89          HB1       ASP  89  -8.080   2.797   6.659
  645    H    ARG  90           HN       ARG  90  -4.490   2.657   8.674
  646    HA   ARG  90           HA       ARG  90  -6.321   2.228  10.951
  647   1HB   ARG  90          HB2       ARG  90  -4.205   0.337   9.899
  648   2HB   ARG  90          HB1       ARG  90  -5.162   0.082  11.349
  649   1HG   ARG  90          HG2       ARG  90  -7.137  -0.248  10.109
  650   2HG   ARG  90          HG1       ARG  90  -6.397   0.372   8.630
  651   1HD   ARG  90          HD2       ARG  90  -4.955  -1.523   8.470
  652   2HD   ARG  90          HD1       ARG  90  -5.431  -2.088  10.069
  653    HE   ARG  90           HE       ARG  90  -7.741  -2.313   8.980
  654   1HH1  ARG  90          HH11      ARG  90  -4.727  -2.708   7.232
  655   2HH1  ARG  90          HH12      ARG  90  -5.343  -3.937   6.172
  656   1HH2  ARG  90          HH21      ARG  90  -8.571  -3.911   7.570
  657   2HH2  ARG  90          HH22      ARG  90  -7.534  -4.617   6.361
  658    H    MET  91           HN       MET  91  -3.886   4.029  10.046
  659    HA   MET  91           HA       MET  91  -1.563   3.236  11.297
  660   1HB   MET  91          HB2       MET  91  -0.768   5.514  11.029
  661   2HB   MET  91          HB1       MET  91  -1.654   4.996   9.602
  662   1HG   MET  91          HG2       MET  91  -3.563   6.289  10.243
  663   2HG   MET  91          HG1       MET  91  -2.827   6.687  11.794
  664   1HE   MET  91          HE1       MET  91   0.195   7.222  10.944
  665   2HE   MET  91          HE2       MET  91  -0.707   8.236  12.070
  666   3HE   MET  91          HE3       MET  91   0.159   8.972  10.722
  667    H    THR  92           HN       THR  92  -0.581   3.530  13.189
  668    HA   THR  92           HA       THR  92  -2.178   4.637  15.391
  669    HB   THR  92           HB       THR  92   0.345   2.967  15.529
  670    HG1  THR  92           HG1      THR  92  -1.341   1.736  14.676
  671   1HG2  THR  92          HG21      THR  92  -0.042   4.341  17.519
  672   2HG2  THR  92          HG22      THR  92  -0.288   2.631  17.872
  673   3HG2  THR  92          HG23      THR  92  -1.678   3.695  17.654
  674    HA   PRO  93           HA       PRO  93   0.706   8.111  14.757
  675   1HB   PRO  93          HB2       PRO  93  -1.234   9.526  16.446
  676   2HB   PRO  93          HB1       PRO  93  -0.707   9.895  14.802
  677   1HG   PRO  93          HG2       PRO  93  -3.178   8.973  15.330
  678   2HG   PRO  93          HG1       PRO  93  -2.312   8.548  13.842
  679   1HD   PRO  93          HD2       PRO  93  -2.670   6.944  16.351
  680   2HD   PRO  93          HD1       PRO  93  -2.778   6.421  14.655
  681    H    HIS  94           HN       HIS  94   2.015   9.329  16.254
  682    HA   HIS  94           HA       HIS  94   2.510   7.842  18.654
  683   1HB   HIS  94          HB2       HIS  94   4.228   9.773  19.053
  684   2HB   HIS  94          HB1       HIS  94   4.531   8.546  17.835
  685    HD1  HIS  94           HD1      HIS  94   4.859   9.314  15.479
  686    HD2  HIS  94           HD2      HIS  94   3.478  12.339  17.979
  687    HE1  HIS  94           HE1      HIS  94   5.071  11.440  14.150
  688    HE2  HIS  94           HE2      HIS  94   4.388  13.270  15.739
  689    H    ASN  95           HN       ASN  95   2.185   8.373  20.717
  690    HA   ASN  95           HA       ASN  95  -0.181   9.907  21.146
  691   1HB   ASN  95          HB2       ASN  95  -0.032   9.113  23.450
  692   2HB   ASN  95          HB1       ASN  95   0.234   7.795  22.317
  693   1HD2  ASN  95          HD21      ASN  95   0.980   7.799  25.033
  694   2HD2  ASN  95          HD22      ASN  95   2.705   7.683  25.103
  695    H    GLY  96           HN       GLY  96   3.133  10.674  21.289
  696   1HA   GLY  96          HA2       GLY  96   2.420  13.302  22.345
  697   2HA   GLY  96          HA1       GLY  96   3.691  12.413  23.173
  698    HA   PRO  97           HA       PRO  97   5.354  14.861  19.432
  699   1HB   PRO  97          HB2       PRO  97   6.668  16.779  20.884
  700   2HB   PRO  97          HB1       PRO  97   5.055  16.998  20.197
  701   1HG   PRO  97          HG2       PRO  97   5.850  16.298  22.991
  702   2HG   PRO  97          HG1       PRO  97   4.572  17.391  22.428
  703   1HD   PRO  97          HD2       PRO  97   4.054  14.890  23.308
  704   2HD   PRO  97          HD1       PRO  97   3.096  15.665  22.031
  705    H    ILE  98           HN       ILE  98   6.965  13.571  18.835
  706    HA   ILE  98           HA       ILE  98   8.783  12.433  20.763
  707    HB   ILE  98           HB       ILE  98   8.742  12.153  17.752
  708   1HG1  ILE  98          HG12      ILE  98   7.624  10.391  19.943
  709   2HG1  ILE  98          HG11      ILE  98   6.696  11.300  18.757
  710   1HG2  ILE  98          HG21      ILE  98  10.223  10.572  19.851
  711   2HG2  ILE  98          HG22      ILE  98  10.935  11.648  18.648
  712   3HG2  ILE  98          HG23      ILE  98  10.137  10.161  18.138
  713   1HD1  ILE  98          HD11      ILE  98   7.646   9.909  16.976
  714   2HD1  ILE  98          HD12      ILE  98   6.764   8.961  18.173
  715   3HD1  ILE  98          HD13      ILE  98   8.528   8.981  18.192
  716    HA   PRO  99           HA       PRO  99  11.959  15.586  20.471
  717   1HB   PRO  99          HB2       PRO  99  13.640  13.237  21.207
  718   2HB   PRO  99          HB1       PRO  99  13.572  14.845  21.937
  719   1HG   PRO  99          HG2       PRO  99  12.446  12.757  23.146
  720   2HG   PRO  99          HG1       PRO  99  11.668  14.351  23.168
  721   1HD   PRO  99          HD2       PRO  99  10.993  11.931  21.556
  722   2HD   PRO  99          HD1       PRO  99   9.917  13.148  22.272
  723    H    ARG 100           HN       ARG 100  12.890  16.204  18.656
  724    HA   ARG 100           HA       ARG 100  13.412  14.238  16.564
  725   1HB   ARG 100          HB2       ARG 100  12.097  16.361  16.162
  726   2HB   ARG 100          HB1       ARG 100  13.588  17.253  16.415
  727   1HG   ARG 100          HG2       ARG 100  13.399  17.104  14.104
  728   2HG   ARG 100          HG1       ARG 100  14.545  15.826  14.517
  729   1HD   ARG 100          HD2       ARG 100  11.698  15.055  14.478
  730   2HD   ARG 100          HD1       ARG 100  12.404  15.471  12.919
  731    HE   ARG 100           HE       ARG 100  14.176  13.758  13.540
  732   1HH1  ARG 100          HH11      ARG 100  10.860  13.559  14.673
  733   2HH1  ARG 100          HH12      ARG 100  10.842  11.818  14.718
  734   1HH2  ARG 100          HH21      ARG 100  14.147  11.474  13.612
  735   2HH2  ARG 100          HH22      ARG 100  12.709  10.647  14.120
  736    H    TYR 101           HN       TYR 101  15.349  13.283  17.077
  737    HA   TYR 101           HA       TYR 101  17.630  14.888  17.814
  738   1HB   TYR 101          HB2       TYR 101  17.341  11.939  17.219
  739   2HB   TYR 101          HB1       TYR 101  18.866  12.696  17.666
  740    HD1  TYR 101           HD1      TYR 101  19.065  13.784  19.925
  741    HD2  TYR 101           HD2      TYR 101  15.760  11.327  18.865
  742    HE1  TYR 101           HE1      TYR 101  18.527  13.491  22.307
  743    HE2  TYR 101           HE2      TYR 101  15.211  11.031  21.242
  744    HH   TYR 101           HH       TYR 101  16.404  11.136  23.431
  745    H    VAL 102           HN       VAL 102  16.625  12.955  15.031
  746    HA   VAL 102           HA       VAL 102  18.617  14.391  13.424
  747    HB   VAL 102           HB       VAL 102  18.655  12.406  11.903
  748   1HG1  VAL 102          HG11      VAL 102  20.116  11.047  13.335
  749   2HG1  VAL 102          HG12      VAL 102  19.526  11.919  14.750
  750   3HG1  VAL 102          HG13      VAL 102  20.442  12.771  13.508
  751   1HG2  VAL 102          HG21      VAL 102  17.172  11.066  14.166
  752   2HG2  VAL 102          HG22      VAL 102  17.873  10.247  12.770
  753   3HG2  VAL 102          HG23      VAL 102  16.541  11.381  12.549